1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine

C14H21N5 — CID 106579096

IUPAC1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine
SMILESCn1ccc(CNc2nccn2C2CCCCC2)n1
InChIInChI=1S/C14H21N5/c1-18-9-7-12(17-18)11-16-14-15-8-10-19(14)13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,15,16)
InChIKeyCHBYWIXIJMLXPM-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.73
Rot. Bonds4

About 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine

1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine (PubChem CID 106579096) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine
PubChem CID106579096
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine
SMILESCn1ccc(CNc2nccn2C2CCCCC2)n1
InChIInChI=1S/C14H21N5/c1-18-9-7-12(17-18)11-16-14-15-8-10-19(14)13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,15,16)
InChIKeyCHBYWIXIJMLXPM-UHFFFAOYSA-N
XLogP2.73
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclohexyl-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine
CID 106569352
1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine
CID 106566109
1-cyclohexyl-N-[(2-ethylphenyl)methyl]imidazol-2-amine
CID 106574558
1-cyclohexyl-N-[(4-fluorophenyl)methyl]imidazol-2-amine
CID 106558880
1-cyclohexyl-N-[(3,4-difluorophenyl)methyl]imidazol-2-amine
CID 106565229
1-cyclopentyl-N-(2-piperidin-1-ylethyl)imidazol-2-amine
CID 106565073
1-cyclohexyl-N-(2-imidazol-1-ylethyl)imidazol-2-amine
CID 106569297
1-cyclopentyl-N-(thiophen-2-ylmethyl)imidazol-2-amine
CID 106561409
1-cyclohexyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazol-2-amine
CID 106566290
1-cyclohexyl-N-(2-cyclopropylethyl)imidazol-2-amine
CID 106575828
1-cyclopropyl-N-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106573717
1-cyclopentyl-N-(2,3-dimethylbutyl)imidazol-2-amine
CID 106575250

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine?
The IUPAC name of 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine (CID 106579096) is 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine.
What is the SMILES notation for 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine?
The canonical SMILES for 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine is Cn1ccc(CNc2nccn2C2CCCCC2)n1.
What is the InChIKey of 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine?
The InChIKey is CHBYWIXIJMLXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-18-9-7-12(17-18)11-16-14-15-8-10-19(14)13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,15,16).
What are the key properties of 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine?
1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine has a molecular weight of 259.36 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine is sourced from PubChem (CID 106579096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).