1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid

C15H17N3O3 — CID 119114103

IUPAC1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCCCC1)c1ccc2nccn2c1
InChIInChI=1S/C15H17N3O3/c19-13(11-4-5-12-16-8-9-18(12)10-11)17-15(14(20)21)6-2-1-3-7-15/h4-5,8-10H,1-3,6-7H2,(H,17,19)(H,20,21)
InChIKeyYTRDRGMZIVQLFX-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.85
Rot. Bonds3

About 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid

1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid (PubChem CID 119114103) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid
PubChem CID119114103
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCCCC1)c1ccc2nccn2c1
InChIInChI=1S/C15H17N3O3/c19-13(11-4-5-12-16-8-9-18(12)10-11)17-15(14(20)21)6-2-1-3-7-15/h4-5,8-10H,1-3,6-7H2,(H,17,19)(H,20,21)
InChIKeyYTRDRGMZIVQLFX-UHFFFAOYSA-N
XLogP1.85
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid
CID 119217494
N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
CID 119566109
azepan-1-yl(imidazo[1,2-a]pyridin-6-yl)methanone
CID 110704027
N-[1-(1-morpholin-4-ylcyclopentyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 86778313
N-[2-(cycloheptylamino)ethyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
CID 119619984
1-[(2-methylpyridine-4-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 106752503
1-[[6-(dimethylamino)pyridine-3-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 43169367
N-(4-fluorophenyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 110704051
(3R)-1-(imidazo[1,2-a]pyridine-6-carbonyl)-3-methylpyrrolidine-3-carboxylic acid
CID 129397514
1-[[4-(trifluoromethyl)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 45427620
1-[(3,4-dihydroxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 67604335
N-[[4-(2-azaspiro[5.5]undecan-2-ylsulfonyl)phenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 153192558

Frequently Asked Questions

What is the IUPAC name of 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid?
The IUPAC name of 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid (CID 119114103) is 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid.
What is the SMILES notation for 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid?
The canonical SMILES for 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid is O=C(NC1(C(=O)O)CCCCC1)c1ccc2nccn2c1.
What is the InChIKey of 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid?
The InChIKey is YTRDRGMZIVQLFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c19-13(11-4-5-12-16-8-9-18(12)10-11)17-15(14(20)21)6-2-1-3-7-15/h4-5,8-10H,1-3,6-7H2,(H,17,19)(H,20,21).
What are the key properties of 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid?
1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid has a molecular weight of 287.32 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid is sourced from PubChem (CID 119114103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).