1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid

C15H14N2O3 — CID 75355908

IUPAC1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCC1)c1ccc2ncccc2c1
InChIInChI=1S/C15H14N2O3/c18-13(17-15(14(19)20)6-2-7-15)11-4-5-12-10(9-11)3-1-8-16-12/h1,3-5,8-9H,2,6-7H2,(H,17,18)(H,19,20)
InChIKeyJGMUZYZGWFBSRA-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.97
Rot. Bonds3

About 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid

1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid (PubChem CID 75355908) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid.

Molecular Properties

Compound Name1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid
PubChem CID75355908
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCC1)c1ccc2ncccc2c1
InChIInChI=1S/C15H14N2O3/c18-13(17-15(14(19)20)6-2-7-15)11-4-5-12-10(9-11)3-1-8-16-12/h1,3-5,8-9H,2,6-7H2,(H,17,18)(H,19,20)
InChIKeyJGMUZYZGWFBSRA-UHFFFAOYSA-N
XLogP1.97
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1,3-benzothiazole-6-carbonylamino)cyclobutane-1-carboxylic acid
CID 81157747
N-pyridin-4-ylquinoline-6-carboxamide
CID 53313330
1-[(3-aminopyridine-2-carbonyl)amino]cyclobutane-1-carboxylic acid
CID 104742633
ethane;quinoline-6-carboxylic acid
CID 91364452
2-methyl-2-(quinoline-6-carbonylamino)propanoic acid
CID 62849360
2-methyl-3-(quinoline-6-carbonylamino)propanoic acid
CID 55126598
N-quinolin-6-ylbenzamide
CID 833617
1-[(3-methylpyridine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 62338755
1-[(3-methoxy-4-methylbenzoyl)amino]cyclobutane-1-carboxylic acid
CID 81158397
1-[(2-methylpyridine-4-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 106752503
N-(2-chloroethyl)quinoline-6-carboxamide
CID 62874874
N-[[1-(ethoxymethyl)cyclobutyl]methyl]quinoline-6-carboxamide
CID 122558840

Frequently Asked Questions

What is the IUPAC name of 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid?
The IUPAC name of 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid (CID 75355908) is 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid.
What is the SMILES notation for 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid?
The canonical SMILES for 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid is O=C(NC1(C(=O)O)CCC1)c1ccc2ncccc2c1.
What is the InChIKey of 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid?
The InChIKey is JGMUZYZGWFBSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c18-13(17-15(14(19)20)6-2-7-15)11-4-5-12-10(9-11)3-1-8-16-12/h1,3-5,8-9H,2,6-7H2,(H,17,18)(H,19,20).
What are the key properties of 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid?
1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid has a molecular weight of 270.29 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(quinoline-6-carbonylamino)cyclobutane-1-carboxylic acid is sourced from PubChem (CID 75355908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).