[1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol

C11H19N3O — CID 62521339

IUPAC[1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol
SMILESCn1ccnc1NC1(CO)CCCCC1
InChIInChI=1S/C11H19N3O/c1-14-8-7-12-10(14)13-11(9-15)5-3-2-4-6-11/h7-8,15H,2-6,9H2,1H3,(H,12,13)
InChIKeyOKWAFBYGDRRKAR-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.53
Rot. Bonds3

About [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol

[1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol (PubChem CID 62521339) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol
PubChem CID62521339
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name[1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol
SMILESCn1ccnc1NC1(CO)CCCCC1
InChIInChI=1S/C11H19N3O/c1-14-8-7-12-10(14)13-11(9-15)5-3-2-4-6-11/h7-8,15H,2-6,9H2,1H3,(H,12,13)
InChIKeyOKWAFBYGDRRKAR-UHFFFAOYSA-N
XLogP1.53
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol?
The IUPAC name of [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol (CID 62521339) is [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol is Cn1ccnc1NC1(CO)CCCCC1.
What is the InChIKey of [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol?
The InChIKey is OKWAFBYGDRRKAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-14-8-7-12-10(14)13-11(9-15)5-3-2-4-6-11/h7-8,15H,2-6,9H2,1H3,(H,12,13).
What are the key properties of [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol?
[1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol has a molecular weight of 209.29 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-methylimidazol-2-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 62521339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).