(2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide

C13H26N2O — CID 103903038

IUPAC(2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
SMILESCCC1CCCC(N[C@H](C)C(=O)N(C)C)C1
InChIInChI=1S/C13H26N2O/c1-5-11-7-6-8-12(9-11)14-10(2)13(16)15(3)4/h10-12,14H,5-9H2,1-4H3/t10-,11?,12?/m1/s1
InChIKeyZPJGMFFYSILJEX-VOMCLLRMSA-N
MW226.36 g/mol
LogP2.02
Rot. Bonds4

About (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide

(2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide (PubChem CID 103903038) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name(2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
PubChem CID103903038
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name(2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
SMILESCCC1CCCC(N[C@H](C)C(=O)N(C)C)C1
InChIInChI=1S/C13H26N2O/c1-5-11-7-6-8-12(9-11)14-10(2)13(16)15(3)4/h10-12,14H,5-9H2,1-4H3/t10-,11?,12?/m1/s1
InChIKeyZPJGMFFYSILJEX-VOMCLLRMSA-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

2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
CID 43573917
N-ethyl-2-[(3-ethylcyclopentyl)amino]-N-methylpropanamide
CID 103107637
1-(azepan-1-yl)-2-[(3-ethylcyclohexyl)amino]propan-1-one
CID 64741045
N-butan-2-yl-2-[(3-ethylcyclohexyl)amino]propanamide
CID 64741063
3-[(3-ethylcyclohexyl)amino]-N-methylbutanamide
CID 115723133
2-(cyclobutylamino)-N-ethyl-N-methylpropanamide
CID 103108088
3-[[1-(diethylamino)-1-oxopropan-2-yl]amino]cyclohexane-1-carboxylic acid
CID 63044247
2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
CID 61467050
3-[(3-ethylcyclohexyl)amino]-4-methylpentan-1-ol
CID 115656026
(2R)-N,N-dimethyl-2-[(4-methylcyclohexyl)amino]propanamide
CID 92666114
N,N-dimethyl-2-[(4-propan-2-ylcyclohexyl)amino]propanamide
CID 55106384
5-[1-[(3-ethylcyclohexyl)amino]ethyl]furan-2-carboxylic acid
CID 103253786

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
The IUPAC name of (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide (CID 103903038) is (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide.
What is the SMILES notation for (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
The canonical SMILES for (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide is CCC1CCCC(N[C@H](C)C(=O)N(C)C)C1.
What is the InChIKey of (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
The InChIKey is ZPJGMFFYSILJEX-VOMCLLRMSA-N. The full InChI is InChI=1S/C13H26N2O/c1-5-11-7-6-8-12(9-11)14-10(2)13(16)15(3)4/h10-12,14H,5-9H2,1-4H3/t10-,11?,12?/m1/s1.
What are the key properties of (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
(2R)-2-[(3-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 (2R)-2-[(3-ethylcyclohexyl)amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 103903038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).