[1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol

C13H23N3O — CID 62525347

IUPAC[1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol
SMILESCCn1ccnc1NC1(CO)CCCC(C)C1
InChIInChI=1S/C13H23N3O/c1-3-16-8-7-14-12(16)15-13(10-17)6-4-5-11(2)9-13/h7-8,11,17H,3-6,9-10H2,1-2H3,(H,14,15)
InChIKeyPMAURQXIHIPNOS-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.26
Rot. Bonds4

About [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol

[1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol (PubChem CID 62525347) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol
PubChem CID62525347
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name[1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol
SMILESCCn1ccnc1NC1(CO)CCCC(C)C1
InChIInChI=1S/C13H23N3O/c1-3-16-8-7-14-12(16)15-13(10-17)6-4-5-11(2)9-13/h7-8,11,17H,3-6,9-10H2,1-2H3,(H,14,15)
InChIKeyPMAURQXIHIPNOS-UHFFFAOYSA-N
XLogP2.26
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Cyclohexyl-(1-methylimidazol-2-yl)methanol
CID 13331154
(1-Butylimidazol-2-yl)-cyclohexylmethanol
CID 102490465
(2R)-2-cyclohexyl-2-[(1-methylimidazol-2-yl)methylamino]propan-1-ol
CID 97567526
(2R)-2-cyclohexyl-2-(1H-imidazol-2-ylmethylamino)propan-1-ol
CID 164635126
[1-[[1-(Difluoromethyl)imidazol-2-yl]methylamino]cyclohexyl]methanol
CID 62522399
[1-[[1-(Difluoromethyl)imidazol-2-yl]methylamino]-3-methylcyclohexyl]methanol
CID 62552690
[1-[[1-(Difluoromethyl)imidazol-2-yl]methylamino]-4-methylcyclohexyl]methanol
CID 62553353
(1-Propylimidazol-2-yl)-[3-(trifluoromethyl)cyclohexyl]methanol
CID 105098454
(1-Methylimidazol-2-yl)-[3-(trifluoromethyl)cyclohexyl]methanol
CID 105098884
(1-Ethylimidazol-2-yl)-[3-(trifluoromethyl)cyclohexyl]methanol
CID 105099014
[1-[[1-(Difluoromethyl)imidazol-2-yl]methylamino]-3,3,5-trimethylcyclohexyl]methanol
CID 111440270
[3,3,5-Trimethyl-1-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methylamino]cyclohexyl]methanol
CID 111440276

Frequently Asked Questions

What is the IUPAC name of [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol?
The IUPAC name of [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol (CID 62525347) is [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol.
What is the SMILES notation for [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol?
The canonical SMILES for [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol is CCn1ccnc1NC1(CO)CCCC(C)C1.
What is the InChIKey of [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol?
The InChIKey is PMAURQXIHIPNOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-3-16-8-7-14-12(16)15-13(10-17)6-4-5-11(2)9-13/h7-8,11,17H,3-6,9-10H2,1-2H3,(H,14,15).
What are the key properties of [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol?
[1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol has a molecular weight of 237.35 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-ethylimidazol-2-yl)amino]-3-methylcyclohexyl]methanol is sourced from PubChem (CID 62525347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).