N-benzyl-N-methylpentanamide

C13H19NO — CID 4629611

IUPACN-benzyl-N-methylpentanamide
SMILESCCCCC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C13H19NO/c1-3-4-10-13(15)14(2)11-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyHKCOGIPLCKTXNI-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.84
Rot. Bonds5

About N-benzyl-N-methylpentanamide

N-benzyl-N-methylpentanamide (PubChem CID 4629611) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-benzyl-N-methylpentanamide.

Molecular Properties

Compound NameN-benzyl-N-methylpentanamide
PubChem CID4629611
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-benzyl-N-methylpentanamide
SMILESCCCCC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C13H19NO/c1-3-4-10-13(15)14(2)11-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyHKCOGIPLCKTXNI-UHFFFAOYSA-N
XLogP2.84
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzyl-3-(butylamino)-N-methylpropanamide
CID 109012383
N-benzyl-N-methyl-4-(methylamino)butanamide
CID 60842037
N-benzyl-N-methyl-3-(propylamino)propanamide
CID 109011497
N-benzyl-2-(butylamino)-N-methylacetamide
CID 54816784
N,N'-dibenzyl-N,N'-dimethylpropanediamide
CID 2392235
N-benzyl-N-nitrosopentanamide
CID 102399989
N-benzyl-N-methyl-4-(propan-2-ylamino)butanamide
CID 60850765
N-[(4-bromophenyl)methyl]-N-methyldecanamide
CID 65428442
N-benzyl-N-(2-phenylethyl)pentanamide
CID 112791262
N-[(4-bromophenyl)methyl]-N-methyloctanamide
CID 63531159
N-benzyl-N-butan-2-ylpentanamide
CID 78842113
3-[benzyl(pentanoyl)amino]propanoic acid
CID 82323494

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methylpentanamide?
The IUPAC name of N-benzyl-N-methylpentanamide (CID 4629611) is N-benzyl-N-methylpentanamide.
What is the SMILES notation for N-benzyl-N-methylpentanamide?
The canonical SMILES for N-benzyl-N-methylpentanamide is CCCCC(=O)N(C)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-methylpentanamide?
The InChIKey is HKCOGIPLCKTXNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-3-4-10-13(15)14(2)11-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3.
What are the key properties of N-benzyl-N-methylpentanamide?
N-benzyl-N-methylpentanamide has a molecular weight of 205.30 g/mol, XLogP of 2.84, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methylpentanamide is sourced from PubChem (CID 4629611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).