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Home > Other Heterocycles > 1422061-34-4
1422061-34-4 | N-[(4-methylphenyl)methyl]-1-oxa-2,9-diazaspiro[4.5]dec-2-ene-3-carboxamide
CAS No: 1422061-34-4 Catalog No: AG01DIZQ MDL No:
Product Description
Catalog Number:
AG01DIZQ
Chemical Name:
N-[(4-methylphenyl)methyl]-1-oxa-2,9-diazaspiro[4.5]dec-2-ene-3-carboxamide
CAS Number:
1422061-34-4
Molecular Formula:
C16H21N3O2
Molecular Weight:
287.3568
IUPAC Name:
N-[(4-methylphenyl)methyl]-1-oxa-2,9-diazaspiro[4.5]dec-2-ene-3-carboxamide
InChI:
InChI=1S/C16H21N3O2/c1-12-3-5-13(6-4-12)10-18-15(20)14-9-16(21-19-14)7-2-8-17-11-16/h3-6,17H,2,7-11H2,1H3,(H,18,20)
InChI Key:
JPNSYEDSTXZGCG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CNC(=O)C1=NOC2(C1)CCCNC2
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.163g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
287.363g/mol
Monoisotopic Mass:
287.163g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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