N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide

C13H26N2O — CID 64743974

IUPACN-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide
SMILESCCNC(=O)CCNC1CCCC(CC)C1
InChIInChI=1S/C13H26N2O/c1-3-11-6-5-7-12(10-11)15-9-8-13(16)14-4-2/h11-12,15H,3-10H2,1-2H3,(H,14,16)
InChIKeyLSAQXQIPPBHDFX-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.07
Rot. Bonds6

About N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide

N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide (PubChem CID 64743974) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide.

Molecular Properties

Compound NameN-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide
PubChem CID64743974
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide
SMILESCCNC(=O)CCNC1CCCC(CC)C1
InChIInChI=1S/C13H26N2O/c1-3-11-6-5-7-12(10-11)15-9-8-13(16)14-4-2/h11-12,15H,3-10H2,1-2H3,(H,14,16)
InChIKeyLSAQXQIPPBHDFX-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3-cyclopropylcyclohexyl)amino]-N-ethylpropanamide
CID 113409677
3-[(3-ethylcyclopentyl)amino]-N-prop-2-ynylpropanamide
CID 115653020
5-[(3-ethylcyclohexyl)amino]pentanoic acid
CID 103253769
3-[(3-aminocyclohexyl)amino]-N-(2-methylpropyl)propanamide
CID 113409721
3-[(3-cyclopropylcyclohexyl)amino]-N-propylpropanamide
CID 64623786
3-ethyl-N-(2-ethylsulfonylethyl)cyclohexan-1-amine
CID 64743190
N-cyclohexyl-2-[(3-ethylcyclohexyl)amino]acetamide
CID 64742794
N-propyl-3-[(4-propylcycloheptyl)amino]propanamide
CID 65091128
N-(2-cyanoethyl)-2-[(3-ethylcyclohexyl)amino]acetamide
CID 64743964
4-[(3-ethylcyclohexyl)amino]butan-2-ol
CID 64910708
3-ethyl-N-(2-nitroethyl)cyclohexan-1-amine
CID 142945001
N-(2-cyclobutylethyl)-3-ethylcyclopentan-1-amine
CID 115690186

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide?
The IUPAC name of N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide (CID 64743974) is N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide.
What is the SMILES notation for N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide?
The canonical SMILES for N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide is CCNC(=O)CCNC1CCCC(CC)C1.
What is the InChIKey of N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide?
The InChIKey is LSAQXQIPPBHDFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-3-11-6-5-7-12(10-11)15-9-8-13(16)14-4-2/h11-12,15H,3-10H2,1-2H3,(H,14,16).
What are the key properties of N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide?
N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide has a molecular weight of 226.36 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide is sourced from PubChem (CID 64743974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).