N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide

C14H28N2O — CID 119996085

IUPACN-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide
SMILESCC(CN)CNC(=O)C(C)CC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-11(9-15)10-16-14(17)12(2)8-13-6-4-3-5-7-13/h11-13H,3-10,15H2,1-2H3,(H,16,17)
InChIKeyXJWLNRBYEMFZLI-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.30
Rot. Bonds6

About N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide

N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide (PubChem CID 119996085) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide
PubChem CID119996085
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide
SMILESCC(CN)CNC(=O)C(C)CC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-11(9-15)10-16-14(17)12(2)8-13-6-4-3-5-7-13/h11-13H,3-10,15H2,1-2H3,(H,16,17)
InChIKeyXJWLNRBYEMFZLI-UHFFFAOYSA-N
XLogP2.30
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-2-methylpropyl)-2-(cyclohexylmethyl)butanamide;hydrochloride
CID 119996125
N-(3-aminopropyl)-3-cyclohexyl-2-methylpropanamide
CID 119407411
N-(3-amino-2-methylpropyl)-2-(cyclopentylmethyl)pentanamide;hydrochloride
CID 119995428
3-cyclopentyl-N-[(2S)-2-(dimethylamino)propyl]-2-methylpropanamide
CID 122152789
N-(3-amino-2-methylpropyl)-2-cyclohexylsulfonyl-3-methylbutanamide
CID 119995772
N-(3-amino-2-methylpropyl)-2-cyclopropylacetamide
CID 62667808
N-(1-amino-2-cyclopropylpropan-2-yl)-3-cyclohexyl-2-methylpropanamide;hydrochloride
CID 119574532
N-[2-(aminomethyl)cyclopentyl]-3-cyclohexyl-2-methylpropanamide;hydrochloride
CID 119603444
(2S)-2-[(3-amino-2-hydroxypropyl)amino]-N-tert-butyl-3-cyclohexylpropanamide
CID 10017644
(2R)-2-[(3-cyclopentyl-2-methylpropanoyl)amino]propanoic acid
CID 103791111
1-(3-amino-2-methylpropyl)-3-cyclobutylurea
CID 116658132
N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide
CID 79195699

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide (CID 119996085) is N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide is CC(CN)CNC(=O)C(C)CC1CCCCC1.
What is the InChIKey of N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide?
The InChIKey is XJWLNRBYEMFZLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11(9-15)10-16-14(17)12(2)8-13-6-4-3-5-7-13/h11-13H,3-10,15H2,1-2H3,(H,16,17).
What are the key properties of N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide?
N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide has a molecular weight of 240.39 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-3-cyclohexyl-2-methylpropanamide is sourced from PubChem (CID 119996085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).