1-(3-cyclopropylphenyl)decan-1-ol

C19H30O — CID 79980400

IUPAC1-(3-cyclopropylphenyl)decan-1-ol
SMILESCCCCCCCCCC(O)c1cccc(C2CC2)c1
InChIInChI=1S/C19H30O/c1-2-3-4-5-6-7-8-12-19(20)18-11-9-10-17(15-18)16-13-14-16/h9-11,15-16,19-20H,2-8,12-14H2,1H3
InChIKeyKQSQOPVSYQSRTB-UHFFFAOYSA-N
MW274.45 g/mol
LogP5.74
Rot. Bonds10

About 1-(3-cyclopropylphenyl)decan-1-ol

1-(3-cyclopropylphenyl)decan-1-ol (PubChem CID 79980400) has the molecular formula C19H30O and a molecular weight of 274.45 g/mol. Its IUPAC name is 1-(3-cyclopropylphenyl)decan-1-ol.

Molecular Properties

Compound Name1-(3-cyclopropylphenyl)decan-1-ol
PubChem CID79980400
Molecular FormulaC19H30O
Molecular Weight274.45 g/mol
Exact Mass274.23
IUPAC Name1-(3-cyclopropylphenyl)decan-1-ol
SMILESCCCCCCCCCC(O)c1cccc(C2CC2)c1
InChIInChI=1S/C19H30O/c1-2-3-4-5-6-7-8-12-19(20)18-11-9-10-17(15-18)16-13-14-16/h9-11,15-16,19-20H,2-8,12-14H2,1H3
InChIKeyKQSQOPVSYQSRTB-UHFFFAOYSA-N
XLogP5.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.45
LogP ≤ 55.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-(3-cyclopropylphenyl)decan-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

1-(3-cyclopropylphenyl)heptan-1-ol
CID 79980321
1-(3-cyclopropylphenyl)undecan-1-ol
CID 79973186
1-(3-cyclopropylphenyl)octan-1-ol
CID 79981026
1-(3-cyclobutylphenyl)pentan-1-ol
CID 114601319
1-(4-cyclopropylphenyl)octan-1-ol
CID 79980004
1-(3-cyclobutylphenyl)nonylhydrazine
CID 105342031
1-(3-cyclopropylphenyl)-4-phenylbutan-1-ol
CID 79980245
1-(3-methylphenyl)decan-1-ol
CID 63411280
1-(3-cyclohexylphenyl)propan-1-ol
CID 178189134
1-(3-cyclobutylphenyl)-2-methylhexan-1-ol
CID 114247202
3-amino-1-(3-cyclobutylphenyl)propan-1-ol
CID 114601621
1-(4-cyclohexylphenyl)octan-1-ol
CID 63426970

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropylphenyl)decan-1-ol?
The IUPAC name of 1-(3-cyclopropylphenyl)decan-1-ol (CID 79980400) is 1-(3-cyclopropylphenyl)decan-1-ol.
What is the SMILES notation for 1-(3-cyclopropylphenyl)decan-1-ol?
The canonical SMILES for 1-(3-cyclopropylphenyl)decan-1-ol is CCCCCCCCCC(O)c1cccc(C2CC2)c1.
What is the InChIKey of 1-(3-cyclopropylphenyl)decan-1-ol?
The InChIKey is KQSQOPVSYQSRTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30O/c1-2-3-4-5-6-7-8-12-19(20)18-11-9-10-17(15-18)16-13-14-16/h9-11,15-16,19-20H,2-8,12-14H2,1H3.
What are the key properties of 1-(3-cyclopropylphenyl)decan-1-ol?
1-(3-cyclopropylphenyl)decan-1-ol has a molecular weight of 274.45 g/mol, XLogP of 5.74, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropylphenyl)decan-1-ol is sourced from PubChem (CID 79980400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).