3-(2-cyclohexylethylamino)-2-methylpropanamide

C12H24N2O — CID 60920739

IUPAC3-(2-cyclohexylethylamino)-2-methylpropanamide
SMILESCC(CNCCC1CCCCC1)C(N)=O
InChIInChI=1S/C12H24N2O/c1-10(12(13)15)9-14-8-7-11-5-3-2-4-6-11/h10-11,14H,2-9H2,1H3,(H2,13,15)
InChIKeyWJSAZWAYKBFMIC-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.67
Rot. Bonds6

About 3-(2-cyclohexylethylamino)-2-methylpropanamide

3-(2-cyclohexylethylamino)-2-methylpropanamide (PubChem CID 60920739) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-(2-cyclohexylethylamino)-2-methylpropanamide.

Molecular Properties

Compound Name3-(2-cyclohexylethylamino)-2-methylpropanamide
PubChem CID60920739
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-(2-cyclohexylethylamino)-2-methylpropanamide
SMILESCC(CNCCC1CCCCC1)C(N)=O
InChIInChI=1S/C12H24N2O/c1-10(12(13)15)9-14-8-7-11-5-3-2-4-6-11/h10-11,14H,2-9H2,1H3,(H2,13,15)
InChIKeyWJSAZWAYKBFMIC-UHFFFAOYSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-cyclohexyloxyethylamino)-2-methylpropanamide
CID 63827162
N-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide
CID 62853087
methyl 2-bromo-3-(2-cyclohexylethylamino)propanoate
CID 103240079
N-(2-cyclohexylethyl)-2-methylbutane-1,4-diamine
CID 115202800
1-N-(2-cyclohexylethyl)-4-methylpentane-1,2-diamine
CID 83962626
N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide
CID 79195699
methyl (2R)-3-(cycloheptylmethylamino)-2-methylpropanoate
CID 129354214
(2S)-2-(2-cyclohexylethylamino)-4-methylpentanoic acid
CID 122037122
2-methyl-3-[3-(2-methylpiperidin-1-yl)propylamino]propanamide
CID 43312067
(2R)-2-amino-N-(2-cyclohexylethyl)-3-methylbutanamide
CID 79012516
N-carbamoyl-2-(2-cyclohexylethylamino)acetamide
CID 60920757
2-(2-cyclobutylethylamino)butanamide
CID 115688602

Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclohexylethylamino)-2-methylpropanamide?
The IUPAC name of 3-(2-cyclohexylethylamino)-2-methylpropanamide (CID 60920739) is 3-(2-cyclohexylethylamino)-2-methylpropanamide.
What is the SMILES notation for 3-(2-cyclohexylethylamino)-2-methylpropanamide?
The canonical SMILES for 3-(2-cyclohexylethylamino)-2-methylpropanamide is CC(CNCCC1CCCCC1)C(N)=O.
What is the InChIKey of 3-(2-cyclohexylethylamino)-2-methylpropanamide?
The InChIKey is WJSAZWAYKBFMIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10(12(13)15)9-14-8-7-11-5-3-2-4-6-11/h10-11,14H,2-9H2,1H3,(H2,13,15).
What are the key properties of 3-(2-cyclohexylethylamino)-2-methylpropanamide?
3-(2-cyclohexylethylamino)-2-methylpropanamide has a molecular weight of 212.34 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclohexylethylamino)-2-methylpropanamide is sourced from PubChem (CID 60920739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).