[4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol

C17H26N4O — CID 154816507

IUPAC[4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol
SMILESCC(C)n1cncc1-c1nccn1CC1CCC(CO)CC1
InChIInChI=1S/C17H26N4O/c1-13(2)21-12-18-9-16(21)17-19-7-8-20(17)10-14-3-5-15(11-22)6-4-14/h7-9,12-15,22H,3-6,10-11H2,1-2H3
InChIKeyANTGUCKKSKJQBP-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.13
Rot. Bonds5

About [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol

[4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol (PubChem CID 154816507) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol
PubChem CID154816507
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC Name[4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol
SMILESCC(C)n1cncc1-c1nccn1CC1CCC(CO)CC1
InChIInChI=1S/C17H26N4O/c1-13(2)21-12-18-9-16(21)17-19-7-8-20(17)10-14-3-5-15(11-22)6-4-14/h7-9,12-15,22H,3-6,10-11H2,1-2H3
InChIKeyANTGUCKKSKJQBP-UHFFFAOYSA-N
XLogP3.13
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol with MolForge

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Related Compounds

2-[(4S)-2,2-dimethyloxan-4-yl]-1-[[3-(2-methylpropyl)imidazol-4-yl]methyl]imidazole
CID 95894779
[4-[1-Propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]cyclohexyl]methanol
CID 176105328
1-[(2'-butyl-1H,1'H-2,4'-biimidazol-1-yl)methyl]cyclohexanol
CID 56867054
1-[14-(4,4-Dimethylpentoxy)tetradecyl]-2-[1-[13-(4-methylpentoxy)tridecyl]imidazol-4-yl]imidazole
CID 174353719
2-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-1-[(1-isobutyl-1H-imidazol-5-yl)methyl]-1H-imidazole
CID 70773740
(2S)-4-methyl-2-[4-(1-methyl-1H-imidazol-2-yl)-1H-1,2,3-triazol-1-yl]pentan-1-ol
CID 72902937
2-{[(1-cyclohexyl-1H-imidazol-5-yl)methyl][(1-methyl-1H-imidazol-2-yl)methyl]amino}ethanol
CID 91831063
2-[(4R)-2,2-dimethyloxan-4-yl]-1-[[3-(2-methylpropyl)imidazol-4-yl]methyl]imidazole
CID 95894778
4-Methyl-1-[(2-pyrazin-2-ylimidazol-1-yl)methyl]cyclohexan-1-ol
CID 109411466
2-[1-[(3-Propan-2-ylimidazol-4-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339438
2-[1-[(3-Cyclopropylimidazol-4-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339439
2-[1-[(3-Ethylimidazol-4-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339560

Frequently Asked Questions

What is the IUPAC name of [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol?
The IUPAC name of [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol (CID 154816507) is [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol.
What is the SMILES notation for [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol?
The canonical SMILES for [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol is CC(C)n1cncc1-c1nccn1CC1CCC(CO)CC1.
What is the InChIKey of [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol?
The InChIKey is ANTGUCKKSKJQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-13(2)21-12-18-9-16(21)17-19-7-8-20(17)10-14-3-5-15(11-22)6-4-14/h7-9,12-15,22H,3-6,10-11H2,1-2H3.
What are the key properties of [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol?
[4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol has a molecular weight of 302.42 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[2-(3-propan-2-ylimidazol-4-yl)imidazol-1-yl]methyl]cyclohexyl]methanol is sourced from PubChem (CID 154816507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).