1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide

C16H21N3O2 — CID 119326456

IUPAC1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc3c(c2)NC(=O)CC3)CCCCC1
InChIInChI=1S/C16H21N3O2/c17-16(8-2-1-3-9-16)15(21)18-12-6-4-11-5-7-14(20)19-13(11)10-12/h4,6,10H,1-3,5,7-9,17H2,(H,18,21)(H,19,20)
InChIKeyLJPMXUJGRKKYBJ-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.17
Rot. Bonds2

About 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide

1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide (PubChem CID 119326456) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide
PubChem CID119326456
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc3c(c2)NC(=O)CC3)CCCCC1
InChIInChI=1S/C16H21N3O2/c17-16(8-2-1-3-9-16)15(21)18-12-6-4-11-5-7-14(20)19-13(11)10-12/h4,6,10H,1-3,5,7-9,17H2,(H,18,21)(H,19,20)
InChIKeyLJPMXUJGRKKYBJ-UHFFFAOYSA-N
XLogP2.17
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119293017
1-(aminomethyl)-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119708965
1-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxylic acid
CID 117435901
1-amino-N-(4-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119261942
2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 91962370
N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)piperidine-4-carboxamide;hydrochloride
CID 119326443
1-amino-N-(2-methyl-1H-indol-5-yl)cyclohexane-1-carboxamide
CID 119279938
1-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopropane-1-carboxamide;hydrochloride
CID 119730215
7-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)heptanamide;hydrochloride
CID 119788407
1-amino-N-(2H-benzotriazol-5-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119280142
N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)pyridazine-4-carboxamide
CID 145472242
2-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)pentanamide;hydrochloride
CID 119326451

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide (CID 119326456) is 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide is NC1(C(=O)Nc2ccc3c(c2)NC(=O)CC3)CCCCC1.
What is the InChIKey of 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide?
The InChIKey is LJPMXUJGRKKYBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c17-16(8-2-1-3-9-16)15(21)18-12-6-4-11-5-7-14(20)19-13(11)10-12/h4,6,10H,1-3,5,7-9,17H2,(H,18,21)(H,19,20).
What are the key properties of 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide?
1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide has a molecular weight of 287.36 g/mol, XLogP of 2.17, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 119326456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).