N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide

C15H30N2O — CID 115155864

IUPACN-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide
SMILESCNCCCC(=O)NCC(C)(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-15(2,13-8-5-4-6-9-13)12-17-14(18)10-7-11-16-3/h13,16H,4-12H2,1-3H3,(H,17,18)
InChIKeySUODQCSSHJVATE-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.71
Rot. Bonds7

About N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide

N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide (PubChem CID 115155864) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide
PubChem CID115155864
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide
SMILESCNCCCC(=O)NCC(C)(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-15(2,13-8-5-4-6-9-13)12-17-14(18)10-7-11-16-3/h13,16H,4-12H2,1-3H3,(H,17,18)
InChIKeySUODQCSSHJVATE-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.71
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

N-(2-cyclopentyl-2-methylpropyl)-3-hydroxypropanamide
CID 115139545
3-amino-N-(2-cyclopentyl-2-methylpropyl)propanamide
CID 115153176
3-cyano-N-(2-cyclohexyl-2-methylpropyl)propanamide
CID 115174087
N-(2-hydroxy-2-methylpropyl)-4-(methylamino)butanamide
CID 65107193
N-(2-cyclobutyl-2-methylpropyl)-2-sulfanylacetamide
CID 115167608
4-[(2-cyclopentyl-2-methylpropyl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 115165302
3-amino-N-(2-cyclopentyl-2-methylpropyl)butanamide
CID 115154472
4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide
CID 115156526
4-(methylamino)-N-(2-methyl-2-methylsulfanylpropyl)butanamide
CID 115739817
N-(3-cyclopropylpropyl)-4-(methylamino)butanamide
CID 115740529
N-[(1R)-1-cycloheptylethyl]-4-(methylamino)butanamide
CID 81392455
N-(cyclopropylmethyl)-4-(methylamino)butanamide
CID 60841851

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide?
The IUPAC name of N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide (CID 115155864) is N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide.
What is the SMILES notation for N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide?
The canonical SMILES for N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide is CNCCCC(=O)NCC(C)(C)C1CCCCC1.
What is the InChIKey of N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide?
The InChIKey is SUODQCSSHJVATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-15(2,13-8-5-4-6-9-13)12-17-14(18)10-7-11-16-3/h13,16H,4-12H2,1-3H3,(H,17,18).
What are the key properties of N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide?
N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide has a molecular weight of 254.42 g/mol, XLogP of 2.71, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyl-2-methylpropyl)-4-(methylamino)butanamide is sourced from PubChem (CID 115155864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).