1-cyclopropyltridecan-1-ol

C16H32O — CID 63410999

IUPAC1-cyclopropyltridecan-1-ol
SMILESCCCCCCCCCCCCC(O)C1CC1
InChIInChI=1S/C16H32O/c1-2-3-4-5-6-7-8-9-10-11-12-16(17)15-13-14-15/h15-17H,2-14H2,1H3
InChIKeyUSFQUKZYNGDDJD-UHFFFAOYSA-N
MW240.43 g/mol
LogP5.07
Rot. Bonds12

About 1-cyclopropyltridecan-1-ol

1-cyclopropyltridecan-1-ol (PubChem CID 63410999) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is 1-cyclopropyltridecan-1-ol.

Molecular Properties

Compound Name1-cyclopropyltridecan-1-ol
PubChem CID63410999
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name1-cyclopropyltridecan-1-ol
SMILESCCCCCCCCCCCCC(O)C1CC1
InChIInChI=1S/C16H32O/c1-2-3-4-5-6-7-8-9-10-11-12-16(17)15-13-14-15/h15-17H,2-14H2,1H3
InChIKeyUSFQUKZYNGDDJD-UHFFFAOYSA-N
XLogP5.07
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.43
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-cyclopropyltridecan-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-cyclopropyltetradecan-1-ol
CID 63461268
1-cyclopropylheptan-1-ol
CID 10909821
1-cyclopropylpentan-1-ol
CID 551238
1-cyclooctylundecan-1-ol
CID 80603651
1-(4-tert-butylcyclohexyl)heptan-1-ol
CID 65400919
1-piperidin-4-ylundecan-1-ol
CID 80560155
1-(3-bicyclo[3.1.0]hexanyl)tridecan-1-ol
CID 115789478
1-piperidin-4-ylpentan-1-ol
CID 19599407
1-(3-ethylcyclohexyl)decan-1-ol
CID 65401129
(1S)-1-[(2S,5R)-5-[(2S,5R)-5-[(1R)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]undecan-1-ol
CID 11533144
1-(dioxiran-3-yl)heptan-1-ol
CID 141086578
1-cyclopropyloctylcyclopropane
CID 141276542

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyltridecan-1-ol?
The IUPAC name of 1-cyclopropyltridecan-1-ol (CID 63410999) is 1-cyclopropyltridecan-1-ol.
What is the SMILES notation for 1-cyclopropyltridecan-1-ol?
The canonical SMILES for 1-cyclopropyltridecan-1-ol is CCCCCCCCCCCCC(O)C1CC1.
What is the InChIKey of 1-cyclopropyltridecan-1-ol?
The InChIKey is USFQUKZYNGDDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O/c1-2-3-4-5-6-7-8-9-10-11-12-16(17)15-13-14-15/h15-17H,2-14H2,1H3.
What are the key properties of 1-cyclopropyltridecan-1-ol?
1-cyclopropyltridecan-1-ol has a molecular weight of 240.43 g/mol, XLogP of 5.07, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyltridecan-1-ol is sourced from PubChem (CID 63410999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).