N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide

C11H17N3O2 — CID 81258007

IUPACN-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide
SMILESO=C(NC1(CO)CCCCC1)n1ccnc1
InChIInChI=1S/C11H17N3O2/c15-8-11(4-2-1-3-5-11)13-10(16)14-7-6-12-9-14/h6-7,9,15H,1-5,8H2,(H,13,16)
InChIKeyHYGPYTRAEZIFGP-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.14
Rot. Bonds2

About N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide

N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide (PubChem CID 81258007) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide
PubChem CID81258007
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC NameN-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide
SMILESO=C(NC1(CO)CCCCC1)n1ccnc1
InChIInChI=1S/C11H17N3O2/c15-8-11(4-2-1-3-5-11)13-10(16)14-7-6-12-9-14/h6-7,9,15H,1-5,8H2,(H,13,16)
InChIKeyHYGPYTRAEZIFGP-UHFFFAOYSA-N
XLogP1.14
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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)cyclopentyl]-4-imidazol-1-ylpyridine-2-carboxamide
CID 127772180
2-(3-aminopyrazol-1-yl)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62524961
N-[1-(hydroxymethyl)cyclohexyl]pyridine-3-carboxamide
CID 62520732
N-(3-piperidin-1-ylpropyl)imidazole-1-carboxamide
CID 81258075
N-[1-(hydroxymethyl)cyclopentyl]pyrazine-2-carboxamide
CID 62519593
imidazol-1-yl-(1-phenylcyclopentyl)methanone
CID 110464353
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazole-1-carboxamide
CID 106103205
1-imidazol-1-ylcyclooctane-1-carboxylic acid
CID 82235123
N-(2-sulfanylethyl)imidazole-1-carboxamide
CID 58107367
1-[1-(hydroxymethyl)cyclopentyl]-3-(1-methylpyrazol-3-yl)urea
CID 111926215

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide (CID 81258007) is N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide is O=C(NC1(CO)CCCCC1)n1ccnc1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide?
The InChIKey is HYGPYTRAEZIFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c15-8-11(4-2-1-3-5-11)13-10(16)14-7-6-12-9-14/h6-7,9,15H,1-5,8H2,(H,13,16).
What are the key properties of N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide?
N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclohexyl]imidazole-1-carboxamide is sourced from PubChem (CID 81258007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).