cyclohepten-1-yl-(3-methylcyclohexyl)methanone

C15H24O — CID 103450394

IUPACcyclohepten-1-yl-(3-methylcyclohexyl)methanone
SMILESCC1CCCC(C(=O)C2=CCCCCC2)C1
InChIInChI=1S/C15H24O/c1-12-7-6-10-14(11-12)15(16)13-8-4-2-3-5-9-13/h8,12,14H,2-7,9-11H2,1H3
InChIKeyFMDYVLSDHPMXKT-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.27
Rot. Bonds2

About cyclohepten-1-yl-(3-methylcyclohexyl)methanone

cyclohepten-1-yl-(3-methylcyclohexyl)methanone (PubChem CID 103450394) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is cyclohepten-1-yl-(3-methylcyclohexyl)methanone.

Molecular Properties

Compound Namecyclohepten-1-yl-(3-methylcyclohexyl)methanone
PubChem CID103450394
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Namecyclohepten-1-yl-(3-methylcyclohexyl)methanone
SMILESCC1CCCC(C(=O)C2=CCCCCC2)C1
InChIInChI=1S/C15H24O/c1-12-7-6-10-14(11-12)15(16)13-8-4-2-3-5-9-13/h8,12,14H,2-7,9-11H2,1H3
InChIKeyFMDYVLSDHPMXKT-UHFFFAOYSA-N
XLogP4.27
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze cyclohepten-1-yl-(3-methylcyclohexyl)methanone 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

cyclohexen-1-yl-(3-methylcyclopentyl)methanone
CID 106651922
cyclohexen-1-yl-(2-methylcyclopentyl)methanone
CID 107176498
azetidin-3-yl(cycloocten-1-yl)methanone
CID 106655454
[(3S)-3-methylcyclohexyl]-phenylmethanone
CID 134867416
cyclohexen-1-yl(oxan-3-yl)methanone
CID 63011735
cycloocten-1-yl-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 106655849
cyclohepten-1-yl(2,3-dihydro-1H-inden-2-yl)methanone
CID 106651930
cyclopenten-1-yl-(2-methylcyclopropyl)methanone
CID 62080123
(3-methylcyclohexyl)-(2-methylphenyl)methanone
CID 54592977
cyclohexen-1-yl-(5-methyloxolan-2-yl)methanone
CID 81329803
trans-(1S,3S)-3-methylcyclohexane-1-carboxylic acid
CID 86308884
[2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone
CID 106655460

Frequently Asked Questions

What is the IUPAC name of cyclohepten-1-yl-(3-methylcyclohexyl)methanone?
The IUPAC name of cyclohepten-1-yl-(3-methylcyclohexyl)methanone (CID 103450394) is cyclohepten-1-yl-(3-methylcyclohexyl)methanone.
What is the SMILES notation for cyclohepten-1-yl-(3-methylcyclohexyl)methanone?
The canonical SMILES for cyclohepten-1-yl-(3-methylcyclohexyl)methanone is CC1CCCC(C(=O)C2=CCCCCC2)C1.
What is the InChIKey of cyclohepten-1-yl-(3-methylcyclohexyl)methanone?
The InChIKey is FMDYVLSDHPMXKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-12-7-6-10-14(11-12)15(16)13-8-4-2-3-5-9-13/h8,12,14H,2-7,9-11H2,1H3.
What are the key properties of cyclohepten-1-yl-(3-methylcyclohexyl)methanone?
cyclohepten-1-yl-(3-methylcyclohexyl)methanone has a molecular weight of 220.36 g/mol, XLogP of 4.27, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohepten-1-yl-(3-methylcyclohexyl)methanone is sourced from PubChem (CID 103450394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).