2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide

C13H26N2O — CID 43573917

IUPAC2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
SMILESCCC1CCC(NC(C)C(=O)N(C)C)CC1
InChIInChI=1S/C13H26N2O/c1-5-11-6-8-12(9-7-11)14-10(2)13(16)15(3)4/h10-12,14H,5-9H2,1-4H3
InChIKeyRGEHPCNUUKGJRK-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.02
Rot. Bonds4

About 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide

2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide (PubChem CID 43573917) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
PubChem CID43573917
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
SMILESCCC1CCC(NC(C)C(=O)N(C)C)CC1
InChIInChI=1S/C13H26N2O/c1-5-11-6-8-12(9-7-11)14-10(2)13(16)15(3)4/h10-12,14H,5-9H2,1-4H3
InChIKeyRGEHPCNUUKGJRK-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
CID 103903038
N-ethyl-2-[(3-ethylcyclopentyl)amino]-N-methylpropanamide
CID 103107637
(2R)-N,N-dimethyl-2-[(4-methylcyclohexyl)amino]propanamide
CID 92666114
N,N-dimethyl-2-[(4-propan-2-ylcyclohexyl)amino]propanamide
CID 55106384
2-(cyclopropylamino)-N,N-diethylpropanamide
CID 43113043
N,N-dimethyl-2-(piperidin-4-ylamino)propanamide
CID 61016597
N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]propanamide
CID 61462353
2-(cyclobutylamino)-N-ethyl-N-methylpropanamide
CID 103108088
2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide
CID 43573998
2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
CID 61467050
2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide
CID 65118585
2-(cycloheptylamino)-N,N-diethylpropanamide
CID 43132181

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide (CID 43573917) is 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide is CCC1CCC(NC(C)C(=O)N(C)C)CC1.
What is the InChIKey of 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
The InChIKey is RGEHPCNUUKGJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-5-11-6-8-12(9-7-11)14-10(2)13(16)15(3)4/h10-12,14H,5-9H2,1-4H3.
What are the key properties of 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide has a molecular weight of 226.36 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 43573917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).