3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide

C17H23N3O2 — CID 119729790

IUPAC3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide
SMILESCC(NC(=O)C1CCC(N)C1)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C17H23N3O2/c1-10(19-17(22)13-2-5-14(18)9-13)11-3-6-15-12(8-11)4-7-16(21)20-15/h3,6,8,10,13-14H,2,4-5,7,9,18H2,1H3,(H,19,22)(H,20,21)
InChIKeyHDGCHZCYNFGKAT-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.88
Rot. Bonds3

About 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide

3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide (PubChem CID 119729790) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide
PubChem CID119729790
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide
SMILESCC(NC(=O)C1CCC(N)C1)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C17H23N3O2/c1-10(19-17(22)13-2-5-14(18)9-13)11-3-6-15-12(8-11)4-7-16(21)20-15/h3,6,8,10,13-14H,2,4-5,7,9,18H2,1H3,(H,19,22)(H,20,21)
InChIKeyHDGCHZCYNFGKAT-UHFFFAOYSA-N
XLogP1.88
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide
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3-amino-N-[1-(3,4-dimethoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 66010445
7-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]heptanamide;hydrochloride
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1-(2-adamantyl)-3-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]urea
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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide (CID 119729790) is 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide is CC(NC(=O)C1CCC(N)C1)c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is HDGCHZCYNFGKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-10(19-17(22)13-2-5-14(18)9-13)11-3-6-15-12(8-11)4-7-16(21)20-15/h3,6,8,10,13-14H,2,4-5,7,9,18H2,1H3,(H,19,22)(H,20,21).
What are the key properties of 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide?
3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 1.88, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119729790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).