2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol

C18H35NO2 — CID 62708698

IUPAC2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(O)C(CN(CCO)C2CCCCC2)C1
InChIInChI=1S/C18H35NO2/c1-14(2)15-8-9-18(21)16(12-15)13-19(10-11-20)17-6-4-3-5-7-17/h14-18,20-21H,3-13H2,1-2H3
InChIKeyNZIASUGGEBLSDH-UHFFFAOYSA-N
MW297.48 g/mol
LogP3.05
Rot. Bonds6

About 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol

2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol (PubChem CID 62708698) has the molecular formula C18H35NO2 and a molecular weight of 297.48 g/mol. Its IUPAC name is 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol
PubChem CID62708698
Molecular FormulaC18H35NO2
Molecular Weight297.48 g/mol
Exact Mass297.27
IUPAC Name2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(O)C(CN(CCO)C2CCCCC2)C1
InChIInChI=1S/C18H35NO2/c1-14(2)15-8-9-18(21)16(12-15)13-19(10-11-20)17-6-4-3-5-7-17/h14-18,20-21H,3-13H2,1-2H3
InChIKeyNZIASUGGEBLSDH-UHFFFAOYSA-N
XLogP3.05
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.48
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol 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

2-[(2-amino-5-propan-2-ylcyclohexyl)methyl-cyclohexylamino]ethanol
CID 62707763
2-[cyclopentyl-[[2-(methylamino)-5-propan-2-ylcyclohexyl]methyl]amino]ethanol
CID 62704902
2-[[bis(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol
CID 55105830
2-[cyclopropyl-[[2-(methylamino)-5-propan-2-ylcyclohexyl]methyl]amino]ethanol
CID 62708874
2-[[cyclopropyl(2-hydroxyethyl)amino]methyl]-4-methylcyclohexan-1-ol
CID 62610271
2-[[cyclopropyl(2-hydroxyethyl)amino]methyl]cyclopentan-1-ol
CID 62610274
2-[[methyl(propan-2-yl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol
CID 62708502
2-[(2-aminocycloheptyl)methyl-cyclobutylamino]ethanol
CID 102870978
2-ethyl-4-propan-2-ylcyclohexan-1-ol
CID 58534339
2-[[butyl(ethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol
CID 55106445
2-(2-fluoroethyl)-4-propan-2-ylcyclohexan-1-ol
CID 80694968
2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol
CID 104517048

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol (CID 62708698) is 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol is CC(C)C1CCC(O)C(CN(CCO)C2CCCCC2)C1.
What is the InChIKey of 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol?
The InChIKey is NZIASUGGEBLSDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO2/c1-14(2)15-8-9-18(21)16(12-15)13-19(10-11-20)17-6-4-3-5-7-17/h14-18,20-21H,3-13H2,1-2H3.
What are the key properties of 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol?
2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol has a molecular weight of 297.48 g/mol, XLogP of 3.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 62708698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).