2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol

C13H27NO — CID 43085230

IUPAC2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol
SMILESCCC(C)(C)C1CCC(NCCO)CC1
InChIInChI=1S/C13H27NO/c1-4-13(2,3)11-5-7-12(8-6-11)14-9-10-15/h11-12,14-15H,4-10H2,1-3H3
InChIKeyQCIWZXBFBAKTDF-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.56
Rot. Bonds5

About 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol

2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol (PubChem CID 43085230) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol.

Molecular Properties

Compound Name2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol
PubChem CID43085230
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol
SMILESCCC(C)(C)C1CCC(NCCO)CC1
InChIInChI=1S/C13H27NO/c1-4-13(2,3)11-5-7-12(8-6-11)14-9-10-15/h11-12,14-15H,4-10H2,1-3H3
InChIKeyQCIWZXBFBAKTDF-UHFFFAOYSA-N
XLogP2.56
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol 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

N-(2-cyclohexylethyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 63448545
3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
CID 60867060
N-(3-methoxy-3-methylbutyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 106675122
N-[4-(2-methylbutan-2-yl)cyclohexyl]-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 29033402
methyl 4-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]butanoate
CID 60782419
4-(2-methylbutan-2-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohexan-1-amine
CID 115653405
2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]butan-1-ol
CID 43079522
5-[(4-tert-butylcyclohexyl)amino]pentan-1-ol
CID 107302888
4-(2-methylbutan-2-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]cyclohexan-1-amine
CID 63242595
[3-[[[4-(2-methylbutan-2-yl)cyclohexyl]amino]methyl]phenyl]methanol
CID 103699215
4-(2-methylbutan-2-yl)-N-[(3-methylcyclopentyl)methyl]cyclohexan-1-amine
CID 107412240
N-[(4-ethylphenyl)methyl]-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 43224673

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol?
The IUPAC name of 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol (CID 43085230) is 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol.
What is the SMILES notation for 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol?
The canonical SMILES for 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol is CCC(C)(C)C1CCC(NCCO)CC1.
What is the InChIKey of 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol?
The InChIKey is QCIWZXBFBAKTDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-4-13(2,3)11-5-7-12(8-6-11)14-9-10-15/h11-12,14-15H,4-10H2,1-3H3.
What are the key properties of 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol?
2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol has a molecular weight of 213.36 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol is sourced from PubChem (CID 43085230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).