5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid

C14H20N4O3 — CID 134070090

IUPAC5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid
SMILESCn1cnc2c1C(C(=O)O)CN(C(=O)NC1CCCC1)C2
InChIInChI=1S/C14H20N4O3/c1-17-8-15-11-7-18(6-10(12(11)17)13(19)20)14(21)16-9-4-2-3-5-9/h8-10H,2-7H2,1H3,(H,16,21)(H,19,20)
InChIKeyBJSSRMNBYRYGTB-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.06
Rot. Bonds2

About 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid

5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid (PubChem CID 134070090) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid
PubChem CID134070090
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid
SMILESCn1cnc2c1C(C(=O)O)CN(C(=O)NC1CCCC1)C2
InChIInChI=1S/C14H20N4O3/c1-17-8-15-11-7-18(6-10(12(11)17)13(19)20)14(21)16-9-4-2-3-5-9/h8-10H,2-7H2,1H3,(H,16,21)(H,19,20)
InChIKeyBJSSRMNBYRYGTB-UHFFFAOYSA-N
XLogP1.06
TPSA87.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopentylcarbamoyl)-3,4-dihydro-1H-isoquinoline-4-carboxylic acid
CID 65262768
N-cyclopropyl-1-methyl-5-(2-phenylmethoxyethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxamide
CID 133140996
(3R)-N-cyclohexyl-3-methylpyrrolidine-1-carboxamide
CID 66581198
N-cyclopentyl-3-[(4-methyl-1,2,4-triazol-3-yl)methyl]piperidine-1-carboxamide
CID 110203887
N-cyclopentyl-3-hydroxy-4-methylpiperidine-1-carboxamide
CID 103896284
N-cyclopentyl-3-(dimethylamino)pyrrolidine-1-carboxamide
CID 115610399
N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 106313541
1-ethyl-5-(oxolane-3-carbonyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid
CID 134078751
N-cyclohexyl-3-(N-methylanilino)azetidine-1-carboxamide
CID 23139887
(3S,5S)-N-cyclohexyl-3,5-dimethylpiperidine-1-carboxamide
CID 1332142
(3R)-3-amino-N-cyclopentylpyrrolidine-1-carboxamide
CID 115301653
N-cyclohexyl-3-methyl-4-oxopiperidine-1-carboxamide
CID 114500022

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid?
The IUPAC name of 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid (CID 134070090) is 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid.
What is the SMILES notation for 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid?
The canonical SMILES for 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid is Cn1cnc2c1C(C(=O)O)CN(C(=O)NC1CCCC1)C2.
What is the InChIKey of 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid?
The InChIKey is BJSSRMNBYRYGTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-17-8-15-11-7-18(6-10(12(11)17)13(19)20)14(21)16-9-4-2-3-5-9/h8-10H,2-7H2,1H3,(H,16,21)(H,19,20).
What are the key properties of 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid?
5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid has a molecular weight of 292.34 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopentylcarbamoyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-7-carboxylic acid is sourced from PubChem (CID 134070090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).