4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide

C15H30N2O — CID 115156526

IUPAC4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide
SMILESCC(CN)CC(=O)NCC(C)(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-12(10-16)9-14(18)17-11-15(2,3)13-7-5-4-6-8-13/h12-13H,4-11,16H2,1-3H3,(H,17,18)
InChIKeyIIUMHLXMVJDQFF-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.69
Rot. Bonds6

About 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide

4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide (PubChem CID 115156526) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide.

Molecular Properties

Compound Name4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide
PubChem CID115156526
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide
SMILESCC(CN)CC(=O)NCC(C)(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-12(10-16)9-14(18)17-11-15(2,3)13-7-5-4-6-8-13/h12-13H,4-11,16H2,1-3H3,(H,17,18)
InChIKeyIIUMHLXMVJDQFF-UHFFFAOYSA-N
XLogP2.69
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2-cyclopentyl-2-methylpropyl)butanamide
CID 115154472
3-amino-N-(2-cyclopentyl-2-methylpropyl)propanamide
CID 115153176
4-amino-3-methyl-N-(2,2,3,3-tetramethylbutyl)butanamide
CID 115156508
N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine
CID 115198967
N-(2-cyclopentyl-2-methylpropyl)-3-hydroxypropanamide
CID 115139545
4-amino-N-cyclohexyl-3-methylbutanamide
CID 81070976
N-(2-cyclobutyl-2-methylpropyl)-2-sulfanylacetamide
CID 115167608
4-[(2-cyclopentyl-2-methylpropyl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 115165302
N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide
CID 115155864
N-(2-cyclohexyl-2-methylpropyl)-2-(hydroxymethyl)-3-methylbutanamide
CID 115187449
3-cyano-N-(2-cyclohexyl-2-methylpropyl)propanamide
CID 115174087
4-[(4-amino-3-methylbutanoyl)amino]-3-hydroxy-3-methylbutanoic acid
CID 81079399

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide?
The IUPAC name of 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide (CID 115156526) is 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide.
What is the SMILES notation for 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide?
The canonical SMILES for 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide is CC(CN)CC(=O)NCC(C)(C)C1CCCCC1.
What is the InChIKey of 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide?
The InChIKey is IIUMHLXMVJDQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12(10-16)9-14(18)17-11-15(2,3)13-7-5-4-6-8-13/h12-13H,4-11,16H2,1-3H3,(H,17,18).
What are the key properties of 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide?
4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide has a molecular weight of 254.42 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide is sourced from PubChem (CID 115156526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).