N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide

C14H28N2O — CID 62853087

IUPACN-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide
SMILESCCNCC(C)C(=O)NCCC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-3-15-11-12(2)14(17)16-10-9-13-7-5-4-6-8-13/h12-13,15H,3-11H2,1-2H3,(H,16,17)
InChIKeyWPNOAJCBDPZVBG-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.32
Rot. Bonds7

About N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide

N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide (PubChem CID 62853087) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide
PubChem CID62853087
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide
SMILESCCNCC(C)C(=O)NCCC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-3-15-11-12(2)14(17)16-10-9-13-7-5-4-6-8-13/h12-13,15H,3-11H2,1-2H3,(H,16,17)
InChIKeyWPNOAJCBDPZVBG-UHFFFAOYSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide?
The IUPAC name of N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide (CID 62853087) is N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide.
What is the SMILES notation for N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide?
The canonical SMILES for N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide is CCNCC(C)C(=O)NCCC1CCCCC1.
What is the InChIKey of N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide?
The InChIKey is WPNOAJCBDPZVBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-15-11-12(2)14(17)16-10-9-13-7-5-4-6-8-13/h12-13,15H,3-11H2,1-2H3,(H,16,17).
What are the key properties of N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide?
N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide has a molecular weight of 240.39 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide is sourced from PubChem (CID 62853087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).