1-methyl-2-pentadecylcyclopropane

C19H38 — CID 54385825

IUPAC1-methyl-2-pentadecylcyclopropane
SMILESCCCCCCCCCCCCCCCC1CC1C
InChIInChI=1S/C19H38/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-18(19)2/h18-19H,3-17H2,1-2H3
InChIKeyGFLNHNNVTCHMFH-UHFFFAOYSA-N
MW266.51 g/mol
LogP7.12
Rot. Bonds14

About 1-methyl-2-pentadecylcyclopropane

1-methyl-2-pentadecylcyclopropane (PubChem CID 54385825) has the molecular formula C19H38 and a molecular weight of 266.51 g/mol. Its IUPAC name is 1-methyl-2-pentadecylcyclopropane.

Molecular Properties

Compound Name1-methyl-2-pentadecylcyclopropane
PubChem CID54385825
Molecular FormulaC19H38
Molecular Weight266.51 g/mol
Exact Mass266.30
IUPAC Name1-methyl-2-pentadecylcyclopropane
SMILESCCCCCCCCCCCCCCCC1CC1C
InChIInChI=1S/C19H38/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-18(19)2/h18-19H,3-17H2,1-2H3
InChIKeyGFLNHNNVTCHMFH-UHFFFAOYSA-N
XLogP7.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.51
LogP ≤ 57.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1-methyl-2-pentadecylcyclopropane 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-methyl-2-[6-(2-tetradecylcyclopropyl)hexyl]cyclopropane
CID 123959869
trans-(1R,2S)-1-butyl-2-methylcyclopropane
CID 102002542
cis-(1S,2S)-1-butyl-2-methylcyclopropane
CID 15579941
1-(7,7-dimethylheptadecyl)-2-methylcyclopropane
CID 123261970
1,2-dioctylcyclopropane
CID 21337627
1-hexyl-2-undecylcyclopropane
CID 58049498
2-hexyl-4-methylbicyclo[3.1.0]hexane
CID 163738205
bicyclo[5.1.0]octane;1-butyl-2-methylcyclopropane;bis(octane)
CID 173410079
1-propyl-2-undecylcyclopropane
CID 123636027
1-butyl-2-[8-(2-butylcyclopropyl)octyl]cyclopropane
CID 23590146
trans-(1S,2S)-1-butyl-2-pentylcyclopropane
CID 91692463
1-decyl-2-methylcyclohexane
CID 123746851

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-pentadecylcyclopropane?
The IUPAC name of 1-methyl-2-pentadecylcyclopropane (CID 54385825) is 1-methyl-2-pentadecylcyclopropane.
What is the SMILES notation for 1-methyl-2-pentadecylcyclopropane?
The canonical SMILES for 1-methyl-2-pentadecylcyclopropane is CCCCCCCCCCCCCCCC1CC1C.
What is the InChIKey of 1-methyl-2-pentadecylcyclopropane?
The InChIKey is GFLNHNNVTCHMFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-18(19)2/h18-19H,3-17H2,1-2H3.
What are the key properties of 1-methyl-2-pentadecylcyclopropane?
1-methyl-2-pentadecylcyclopropane has a molecular weight of 266.51 g/mol, XLogP of 7.12, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-pentadecylcyclopropane is sourced from PubChem (CID 54385825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).