N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one

C24H50N2O2 — CID 159813706

IUPACN-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one
SMILESCC.CC.CC(C)C(=O)N(C)C1CCCCC1.CC(C)C(=O)N1CCCCC1
InChIInChI=1S/C11H21NO.C9H17NO.2C2H6/c1-9(2)11(13)12(3)10-7-5-4-6-8-10;1-8(2)9(11)10-6-4-3-5-7-10;2*1-2/h9-10H,4-8H2,1-3H3;8H,3-7H2,1-2H3;2*1-2H3
InChIKeyNLIUPRQFYHUCAW-UHFFFAOYSA-N
MW398.68 g/mol
LogP6.14
Rot. Bonds3

About N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one

N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one (PubChem CID 159813706) has the molecular formula C24H50N2O2 and a molecular weight of 398.68 g/mol. Its IUPAC name is N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one.

Molecular Properties

Compound NameN-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one
PubChem CID159813706
Molecular FormulaC24H50N2O2
Molecular Weight398.68 g/mol
Exact Mass398.39
IUPAC NameN-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one
SMILESCC.CC.CC(C)C(=O)N(C)C1CCCCC1.CC(C)C(=O)N1CCCCC1
InChIInChI=1S/C11H21NO.C9H17NO.2C2H6/c1-9(2)11(13)12(3)10-7-5-4-6-8-10;1-8(2)9(11)10-6-4-3-5-7-10;2*1-2/h9-10H,4-8H2,1-3H3;8H,3-7H2,1-2H3;2*1-2H3
InChIKeyNLIUPRQFYHUCAW-UHFFFAOYSA-N
XLogP6.14
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.68
LogP ≤ 56.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one 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-(azocan-1-yl)-2-methylpropan-1-one
CID 17164385
1-(azetidin-1-yl)-2-methylpropan-1-one;2-methyl-1-piperidin-1-ylpropan-1-one;2-methyl-1-pyrrolidin-1-ylpropan-1-one
CID 163844566
2-amino-N-cyclooctyl-N-methylpropanamide
CID 83630474
N-cyclohexyl-N,3-dimethyl-2-sulfanylbutanamide
CID 107020891
2-bromo-N-cyclohexyl-N-methylpropanamide
CID 82110244
2-methyl-1-[(3S)-3-propan-2-ylazepan-1-yl]propan-1-one
CID 156676279
3-[cycloheptyl(methyl)amino]-2-methyl-3-oxopropanoic acid
CID 114897396
(2S)-2-amino-N-cyclohexyl-N,3-dimethylbutanamide
CID 61149042
1-(4-cycloheptylpiperazin-1-yl)-2-methylpropan-1-one
CID 59205252
N-cycloheptyl-N-methyl-2-(methylamino)propanamide
CID 62637285
N-methyl-N-(4-methylcyclohexyl)piperidine-1-carboxamide
CID 115578678
2-[cyclopentyl-(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]acetic acid
CID 60833964

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one?
The IUPAC name of N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one (CID 159813706) is N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one.
What is the SMILES notation for N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one?
The canonical SMILES for N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one is CC.CC.CC(C)C(=O)N(C)C1CCCCC1.CC(C)C(=O)N1CCCCC1.
What is the InChIKey of N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one?
The InChIKey is NLIUPRQFYHUCAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO.C9H17NO.2C2H6/c1-9(2)11(13)12(3)10-7-5-4-6-8-10;1-8(2)9(11)10-6-4-3-5-7-10;2*1-2/h9-10H,4-8H2,1-3H3;8H,3-7H2,1-2H3;2*1-2H3.
What are the key properties of N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one?
N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one has a molecular weight of 398.68 g/mol, XLogP of 6.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,2-dimethylpropanamide;ethane;2-methyl-1-piperidin-1-ylpropan-1-one is sourced from PubChem (CID 159813706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).