N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide

C15H18N4O2 — CID 127772180

IUPACN-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide
SMILESO=C(NC1(CO)CCCC1)c1cc(-n2ccnc2)ccn1
InChIInChI=1S/C15H18N4O2/c20-10-15(4-1-2-5-15)18-14(21)13-9-12(3-6-17-13)19-8-7-16-11-19/h3,6-9,11,20H,1-2,4-5,10H2,(H,18,21)
InChIKeyHSXUZPTXJRMFJF-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.30
Rot. Bonds4

About N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide

N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide (PubChem CID 127772180) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide
PubChem CID127772180
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC NameN-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide
SMILESO=C(NC1(CO)CCCC1)c1cc(-n2ccnc2)ccn1
InChIInChI=1S/C15H18N4O2/c20-10-15(4-1-2-5-15)18-14(21)13-9-12(3-6-17-13)19-8-7-16-11-19/h3,6-9,11,20H,1-2,4-5,10H2,(H,18,21)
InChIKeyHSXUZPTXJRMFJF-UHFFFAOYSA-N
XLogP1.30
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(hydroxymethyl)cyclooctyl]-2-imidazol-1-ylpyridine-4-carboxamide
CID 166481441
N-[1-(hydroxymethyl)cyclopentyl]-4-(imidazol-1-ylmethyl)benzamide
CID 110008830
N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide
CID 81258007
4-chloro-N-[4-(hydroxymethyl)oxan-4-yl]pyridine-2-carboxamide
CID 104630550
N-[1-(hydroxymethyl)cyclobutyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 113344802
N-[4-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-3-methyl-1-bicyclo[2.2.2]octanyl]-4-imidazol-1-ylpyridine-2-carboxamide
CID 161199812
N-[1-(hydroxymethyl)cyclobutyl]-1-methylimidazole-4-carboxamide
CID 103881180
(4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone
CID 71801444
N-[1-(hydroxymethyl)cyclopentyl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 62517563
N-[1-(hydroxymethyl)cyclohexyl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 62519875
1-(4-imidazol-1-ylphenyl)cyclopentane-1-carboxylic acid
CID 117394133
3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide
CID 55081325

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide (CID 127772180) is N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide is O=C(NC1(CO)CCCC1)c1cc(-n2ccnc2)ccn1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide?
The InChIKey is HSXUZPTXJRMFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c20-10-15(4-1-2-5-15)18-14(21)13-9-12(3-6-17-13)19-8-7-16-11-19/h3,6-9,11,20H,1-2,4-5,10H2,(H,18,21).
What are the key properties of N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide?
N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide is sourced from PubChem (CID 127772180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).