1-(1-methylcyclopentyl)nonan-1-ol

C15H30O — CID 115784043

IUPAC1-(1-methylcyclopentyl)nonan-1-ol
SMILESCCCCCCCCC(O)C1(C)CCCC1
InChIInChI=1S/C15H30O/c1-3-4-5-6-7-8-11-14(16)15(2)12-9-10-13-15/h14,16H,3-13H2,1-2H3
InChIKeyNWBWRSWJFWJVFE-UHFFFAOYSA-N
MW226.40 g/mol
LogP4.68
Rot. Bonds8

About 1-(1-methylcyclopentyl)nonan-1-ol

1-(1-methylcyclopentyl)nonan-1-ol (PubChem CID 115784043) has the molecular formula C15H30O and a molecular weight of 226.40 g/mol. Its IUPAC name is 1-(1-methylcyclopentyl)nonan-1-ol.

Molecular Properties

Compound Name1-(1-methylcyclopentyl)nonan-1-ol
PubChem CID115784043
Molecular FormulaC15H30O
Molecular Weight226.40 g/mol
Exact Mass226.23
IUPAC Name1-(1-methylcyclopentyl)nonan-1-ol
SMILESCCCCCCCCC(O)C1(C)CCCC1
InChIInChI=1S/C15H30O/c1-3-4-5-6-7-8-11-14(16)15(2)12-9-10-13-15/h14,16H,3-13H2,1-2H3
InChIKeyNWBWRSWJFWJVFE-UHFFFAOYSA-N
XLogP4.68
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.40
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(1-methylcyclopentyl)nonan-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

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclopentyl)nonan-1-ol?
The IUPAC name of 1-(1-methylcyclopentyl)nonan-1-ol (CID 115784043) is 1-(1-methylcyclopentyl)nonan-1-ol.
What is the SMILES notation for 1-(1-methylcyclopentyl)nonan-1-ol?
The canonical SMILES for 1-(1-methylcyclopentyl)nonan-1-ol is CCCCCCCCC(O)C1(C)CCCC1.
What is the InChIKey of 1-(1-methylcyclopentyl)nonan-1-ol?
The InChIKey is NWBWRSWJFWJVFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O/c1-3-4-5-6-7-8-11-14(16)15(2)12-9-10-13-15/h14,16H,3-13H2,1-2H3.
What are the key properties of 1-(1-methylcyclopentyl)nonan-1-ol?
1-(1-methylcyclopentyl)nonan-1-ol has a molecular weight of 226.40 g/mol, XLogP of 4.68, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclopentyl)nonan-1-ol is sourced from PubChem (CID 115784043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).