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89020-35-9 | 2H-1,3-Diazepin-2-one, hexahydro-1-(1-piperidinylmethyl)-
CAS No: 89020-35-9 Catalog No: AG0042SJ MDL No:
Product Description
Catalog Number:
AG0042SJ
Chemical Name:
2H-1,3-Diazepin-2-one, hexahydro-1-(1-piperidinylmethyl)-
CAS Number:
89020-35-9
Molecular Formula:
C11H21N3O
Molecular Weight:
211.3039
IUPAC Name:
1-(piperidin-1-ylmethyl)-1,3-diazepan-2-one
InChI:
InChI=1S/C11H21N3O/c15-11-12-6-2-5-9-14(11)10-13-7-3-1-4-8-13/h1-10H2,(H,12,15)
InChI Key:
ZQJBLGVNUDGKLR-UHFFFAOYSA-N
SMILES:
O=C1NCCCCN1CN1CCCCC1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.168g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.309g/mol
Monoisotopic Mass:
211.168g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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