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

C13H26N2O — CID 61467050

IUPAC2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
SMILESCCC1CCCCC1NC(C)C(=O)N(C)C
InChIInChI=1S/C13H26N2O/c1-5-11-8-6-7-9-12(11)14-10(2)13(16)15(3)4/h10-12,14H,5-9H2,1-4H3
InChIKeyRTYZJRJSGLWAHN-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.02
Rot. Bonds4

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

2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide (PubChem CID 61467050) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
PubChem CID61467050
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
SMILESCCC1CCCCC1NC(C)C(=O)N(C)C
InChIInChI=1S/C13H26N2O/c1-5-11-8-6-7-9-12(11)14-10(2)13(16)15(3)4/h10-12,14H,5-9H2,1-4H3
InChIKeyRTYZJRJSGLWAHN-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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Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide (CID 61467050) is 2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide is CCC1CCCCC1NC(C)C(=O)N(C)C.
What is the InChIKey of 2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
The InChIKey is RTYZJRJSGLWAHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-5-11-8-6-7-9-12(11)14-10(2)13(16)15(3)4/h10-12,14H,5-9H2,1-4H3.
What are the key properties of 2-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide?
2-[(2-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-[(2-ethylcyclohexyl)amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 61467050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).