1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid

C16H20N2O3 — CID 61184724

IUPAC1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCCC1)N1CCCc2ccccc21
InChIInChI=1S/C16H20N2O3/c19-14(20)16(9-3-4-10-16)17-15(21)18-11-5-7-12-6-1-2-8-13(12)18/h1-2,6,8H,3-5,7,9-11H2,(H,17,21)(H,19,20)
InChIKeyHNPHYSBRHKFMIA-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.55
Rot. Bonds2

About 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid

1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid (PubChem CID 61184724) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid
PubChem CID61184724
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCCC1)N1CCCc2ccccc21
InChIInChI=1S/C16H20N2O3/c19-14(20)16(9-3-4-10-16)17-15(21)18-11-5-7-12-6-1-2-8-13(12)18/h1-2,6,8H,3-5,7,9-11H2,(H,17,21)(H,19,20)
InChIKeyHNPHYSBRHKFMIA-UHFFFAOYSA-N
XLogP2.55
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3,4-dihydro-2H-quinoline-1-carbonylamino)benzoic acid
CID 21186078
1-(3,4-dihydro-2H-quinolin-1-yl)-2-(1-hydroxycyclopentyl)ethanone
CID 111432104
3-(3,4-dihydro-2H-quinoline-1-carbonylamino)-2-methylpropanoic acid
CID 62669562
N-cyclopropyl-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 113225655
2,3,4,5-tetrahydro-1-benzazepine-1-carboxylic acid
CID 90953923
N-benzoyl-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 69369112
(2S)-2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-3,3-dimethylbutanoic acid
CID 61184377
3-(3,4-dihydro-2H-quinoline-1-carbonylamino)-3-methylbutanoic acid
CID 64702390
2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-3,3-dimethylbutanoic acid
CID 61184900
(1-aminocyclobutyl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 81179499
N-cycloheptyl-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 69221349
1-(3,4-dihydro-2H-quinolin-1-yl)ethanone;ethane
CID 143423489

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid (CID 61184724) is 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid is O=C(NC1(C(=O)O)CCCC1)N1CCCc2ccccc21.
What is the InChIKey of 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid?
The InChIKey is HNPHYSBRHKFMIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c19-14(20)16(9-3-4-10-16)17-15(21)18-11-5-7-12-6-1-2-8-13(12)18/h1-2,6,8H,3-5,7,9-11H2,(H,17,21)(H,19,20).
What are the key properties of 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid?
1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid has a molecular weight of 288.35 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-quinoline-1-carbonylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 61184724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).