[1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone

C16H29NO — CID 79067139

IUPAC[1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone
SMILESCC1CC(C)CC(C(=O)C2(N(C)C)CCCC2)C1
InChIInChI=1S/C16H29NO/c1-12-9-13(2)11-14(10-12)15(18)16(17(3)4)7-5-6-8-16/h12-14H,5-11H2,1-4H3
InChIKeyBRNNKQKEBXNZAM-UHFFFAOYSA-N
MW251.41 g/mol
LogP3.50
Rot. Bonds3

About [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone

[1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone (PubChem CID 79067139) has the molecular formula C16H29NO and a molecular weight of 251.41 g/mol. Its IUPAC name is [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone.

Molecular Properties

Compound Name[1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone
PubChem CID79067139
Molecular FormulaC16H29NO
Molecular Weight251.41 g/mol
Exact Mass251.22
IUPAC Name[1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone
SMILESCC1CC(C)CC(C(=O)C2(N(C)C)CCCC2)C1
InChIInChI=1S/C16H29NO/c1-12-9-13(2)11-14(10-12)15(18)16(17(3)4)7-5-6-8-16/h12-14H,5-11H2,1-4H3
InChIKeyBRNNKQKEBXNZAM-UHFFFAOYSA-N
XLogP3.50
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.41
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)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

[1-(diethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone
CID 79069711
[1-(dimethylamino)cycloheptyl]-(4-methylcyclohexyl)methanone
CID 79074780
cyclopentyl-[1-(dimethylamino)cycloheptyl]methanone
CID 79074263
[1-(dimethylamino)cyclopentyl]-(oxan-4-yl)methanone
CID 79067927
(1-aminocyclobutyl)-(3,5-dimethylcyclohexyl)methanone
CID 116598551
[1-(dimethylamino)-4-methylcyclohexyl]-(oxan-4-yl)methanone
CID 79066312
[1-(dimethylamino)-3-methylcyclohexyl]-(4-ethylcyclohexyl)methanone
CID 79074454
[1-(dimethylamino)cyclopentyl]-(1,9-dioxaspiro[5.5]undecan-4-yl)methanone
CID 79909690
[1-(dimethylamino)-3-methylcyclohexyl]-(oxolan-3-yl)methanone
CID 79074600
(3,5-dimethylcyclohexyl)-(1-morpholin-4-ylcyclopentyl)methanone
CID 79059527
(3,5-dimethylcyclohexyl)-(2-fluoro-1-methylcyclopropyl)methanone
CID 131000783
1,3-dimethyl-5-prop-1-en-2-ylcyclohexane
CID 90969258

Frequently Asked Questions

What is the IUPAC name of [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone?
The IUPAC name of [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone (CID 79067139) is [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone.
What is the SMILES notation for [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone?
The canonical SMILES for [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone is CC1CC(C)CC(C(=O)C2(N(C)C)CCCC2)C1.
What is the InChIKey of [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone?
The InChIKey is BRNNKQKEBXNZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO/c1-12-9-13(2)11-14(10-12)15(18)16(17(3)4)7-5-6-8-16/h12-14H,5-11H2,1-4H3.
What are the key properties of [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone?
[1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone has a molecular weight of 251.41 g/mol, XLogP of 3.50, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(dimethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone is sourced from PubChem (CID 79067139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).