N-benzyl-N-butan-2-ylbutanamide

C15H23NO — CID 60717440

IUPACN-benzyl-N-butan-2-ylbutanamide
SMILESCCCC(=O)N(Cc1ccccc1)C(C)CC
InChIInChI=1S/C15H23NO/c1-4-9-15(17)16(13(3)5-2)12-14-10-7-6-8-11-14/h6-8,10-11,13H,4-5,9,12H2,1-3H3
InChIKeyVOUABELDCFWGIK-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.61
Rot. Bonds6

About N-benzyl-N-butan-2-ylbutanamide

N-benzyl-N-butan-2-ylbutanamide (PubChem CID 60717440) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is N-benzyl-N-butan-2-ylbutanamide.

Molecular Properties

Compound NameN-benzyl-N-butan-2-ylbutanamide
PubChem CID60717440
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC NameN-benzyl-N-butan-2-ylbutanamide
SMILESCCCC(=O)N(Cc1ccccc1)C(C)CC
InChIInChI=1S/C15H23NO/c1-4-9-15(17)16(13(3)5-2)12-14-10-7-6-8-11-14/h6-8,10-11,13H,4-5,9,12H2,1-3H3
InChIKeyVOUABELDCFWGIK-UHFFFAOYSA-N
XLogP3.61
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzyl-N-butan-2-ylpentanamide
CID 78842113
benzyl(butan-2-yl)carbamic acid
CID 18954164
N-benzyl-N-butan-2-yl-3-(tert-butylamino)propanamide
CID 60937133
N-benzyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide
CID 132649959
N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide
CID 11748505
2-[benzyl(butanoyl)amino]-N-butylbutanamide
CID 132699427
[4-[[butanoyl-[(2R)-butan-2-yl]amino]methyl]phenyl] ethanesulfonate
CID 7419070
N-benzyl-N-butan-2-yl-3-(2,3-dimethoxyphenyl)propanamide
CID 55365562
3-amino-N-butan-2-yl-N-[(4-chlorophenyl)methyl]propanamide
CID 112501851
[3-[[butanoyl(butan-2-yl)amino]methyl]phenyl] methanesulfonate
CID 42775495
N-benzyl-N-[(2S)-1-(2-methylpropylamino)-1-oxo-3-phenylpropan-2-yl]butanamide
CID 100741860
2-[acetyl(butan-2-yl)amino]-N-benzyl-N-propan-2-ylacetamide
CID 113159086

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-butan-2-ylbutanamide?
The IUPAC name of N-benzyl-N-butan-2-ylbutanamide (CID 60717440) is N-benzyl-N-butan-2-ylbutanamide.
What is the SMILES notation for N-benzyl-N-butan-2-ylbutanamide?
The canonical SMILES for N-benzyl-N-butan-2-ylbutanamide is CCCC(=O)N(Cc1ccccc1)C(C)CC.
What is the InChIKey of N-benzyl-N-butan-2-ylbutanamide?
The InChIKey is VOUABELDCFWGIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-4-9-15(17)16(13(3)5-2)12-14-10-7-6-8-11-14/h6-8,10-11,13H,4-5,9,12H2,1-3H3.
What are the key properties of N-benzyl-N-butan-2-ylbutanamide?
N-benzyl-N-butan-2-ylbutanamide has a molecular weight of 233.36 g/mol, XLogP of 3.61, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-butan-2-ylbutanamide is sourced from PubChem (CID 60717440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).