2-[cyclopentyl(methylamino)methyl]butan-1-ol

C11H23NO — CID 116959950

IUPAC2-[cyclopentyl(methylamino)methyl]butan-1-ol
SMILESCCC(CO)C(NC)C1CCCC1
InChIInChI=1S/C11H23NO/c1-3-9(8-13)11(12-2)10-6-4-5-7-10/h9-13H,3-8H2,1-2H3
InChIKeyUCGGFKWNQNCFEQ-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.78
Rot. Bonds5

About 2-[cyclopentyl(methylamino)methyl]butan-1-ol

2-[cyclopentyl(methylamino)methyl]butan-1-ol (PubChem CID 116959950) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2-[cyclopentyl(methylamino)methyl]butan-1-ol.

Molecular Properties

Compound Name2-[cyclopentyl(methylamino)methyl]butan-1-ol
PubChem CID116959950
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2-[cyclopentyl(methylamino)methyl]butan-1-ol
SMILESCCC(CO)C(NC)C1CCCC1
InChIInChI=1S/C11H23NO/c1-3-9(8-13)11(12-2)10-6-4-5-7-10/h9-13H,3-8H2,1-2H3
InChIKeyUCGGFKWNQNCFEQ-UHFFFAOYSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[cyclopentyl(methylamino)methyl]butan-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-[methylamino-(1-methylpiperidin-4-yl)methyl]butan-1-ol
CID 116959958
1-cyclobutyl-2-ethyl-N-methylpropane-1,3-diamine
CID 116960098
methyl 2-[cyclohexyl(methylamino)methyl]butanoate
CID 116960442
1-cyclohexyl-1-(methylamino)propan-2-ol
CID 116859518
1-cyclopropyl-N-methyl-2-propylpentan-1-amine
CID 104994098
2-[cyclobutyl(methylamino)methyl]butanoic acid
CID 116959758
1-cyclopentyl-N-methylpropan-2-amine;2-ethylhexane-1,3-diol
CID 174805893
(2S)-2-cyclooctylbutan-1-ol
CID 122210665
1-cyclooctyl-N,2-dimethylpentan-1-amine
CID 107893689
1-cyclohexyl-2,2-difluoro-N-methylethanamine
CID 80606050
(2S)-2-(cyclooctylamino)butan-1-ol
CID 28723227
(1R)-1-cyclopentylpropan-1-ol;sulfane
CID 161153256

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(methylamino)methyl]butan-1-ol?
The IUPAC name of 2-[cyclopentyl(methylamino)methyl]butan-1-ol (CID 116959950) is 2-[cyclopentyl(methylamino)methyl]butan-1-ol.
What is the SMILES notation for 2-[cyclopentyl(methylamino)methyl]butan-1-ol?
The canonical SMILES for 2-[cyclopentyl(methylamino)methyl]butan-1-ol is CCC(CO)C(NC)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(methylamino)methyl]butan-1-ol?
The InChIKey is UCGGFKWNQNCFEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-9(8-13)11(12-2)10-6-4-5-7-10/h9-13H,3-8H2,1-2H3.
What are the key properties of 2-[cyclopentyl(methylamino)methyl]butan-1-ol?
2-[cyclopentyl(methylamino)methyl]butan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.78, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(methylamino)methyl]butan-1-ol is sourced from PubChem (CID 116959950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).