3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol

C15H31NO — CID 115723128

IUPAC3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol
SMILESCCC(CCO)NC1CC(C)CCC1C(C)C
InChIInChI=1S/C15H31NO/c1-5-13(8-9-17)16-15-10-12(4)6-7-14(15)11(2)3/h11-17H,5-10H2,1-4H3
InChIKeyXYWRHEOIOJDMDS-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.20
Rot. Bonds6

About 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol

3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol (PubChem CID 115723128) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol.

Molecular Properties

Compound Name3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol
PubChem CID115723128
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol
SMILESCCC(CCO)NC1CC(C)CCC1C(C)C
InChIInChI=1S/C15H31NO/c1-5-13(8-9-17)16-15-10-12(4)6-7-14(15)11(2)3/h11-17H,5-10H2,1-4H3
InChIKeyXYWRHEOIOJDMDS-UHFFFAOYSA-N
XLogP3.20
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-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

N-heptan-3-yl-5-methyl-2-propan-2-ylcyclohexan-1-amine
CID 63944923
4,4-dimethyl-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol
CID 106348971
2-(1-hydroxypentan-3-ylamino)cyclobutane-1-carboxylic acid
CID 103267745
5-methyl-N-(2-methylbutyl)-2-propan-2-ylcyclohexan-1-amine
CID 43710072
6-[(5-methyl-2-propan-2-ylcyclohexyl)amino]hexan-1-ol
CID 103922216
3-(cyclopropylamino)pentan-1-ol
CID 83815190
3-[(2-methylthiolan-3-yl)amino]pentan-1-ol
CID 102672340
N-(5-methyl-2-propan-2-ylcyclohexyl)propane-1-sulfonamide
CID 61383803
3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]butanamide
CID 113250248
(2R)-1-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propan-2-ol
CID 103906936
trans-(1S,2S)-2-(1-hydroxypentan-3-ylamino)cyclohexan-1-ol
CID 102731727
(2S)-2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)butanamide;hydrochloride
CID 119304536

Frequently Asked Questions

What is the IUPAC name of 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol?
The IUPAC name of 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol (CID 115723128) is 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol.
What is the SMILES notation for 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol?
The canonical SMILES for 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol is CCC(CCO)NC1CC(C)CCC1C(C)C.
What is the InChIKey of 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol?
The InChIKey is XYWRHEOIOJDMDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-5-13(8-9-17)16-15-10-12(4)6-7-14(15)11(2)3/h11-17H,5-10H2,1-4H3.
What are the key properties of 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol?
3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol has a molecular weight of 241.42 g/mol, XLogP of 3.20, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]pentan-1-ol is sourced from PubChem (CID 115723128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).