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141138-53-6 | 1,8-Naphthyridin-2(1H)-one, 4a,5,6,7,8,8a-hexahydro-5,8-dimethyl-
CAS No: 141138-53-6 Catalog No: AG001FZ3 MDL No:
Product Description
Catalog Number:
AG001FZ3
Chemical Name:
1,8-Naphthyridin-2(1H)-one, 4a,5,6,7,8,8a-hexahydro-5,8-dimethyl-
CAS Number:
141138-53-6
Molecular Formula:
C10H16N2O
Molecular Weight:
180.2468
IUPAC Name:
5,8-dimethyl-1,4a,5,6,7,8a-hexahydro-1,8-naphthyridin-2-one
InChI:
InChI=1S/C10H16N2O/c1-7-5-6-12(2)10-8(7)3-4-9(13)11-10/h3-4,7-8,10H,5-6H2,1-2H3,(H,11,13)
InChI Key:
YNRAVCPGBVSUHM-UHFFFAOYSA-N
SMILES:
CN1CCC(C2C1NC(=O)C=C2)C
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.251g/mol
Monoisotopic Mass:
180.126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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