N-benzylacetamide

C9H11NO — CID 11500

IUPACN-benzylacetamide
SMILESCC(=O)NCc1ccccc1
InChIInChI=1S/C9H11NO/c1-8(11)10-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,10,11)
InChIKeyUZJLYRRDVFWSGA-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.32
Rot. Bonds2

About N-benzylacetamide

N-benzylacetamide (PubChem CID 11500) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is N-benzylacetamide.

Molecular Properties

Compound NameN-benzylacetamide
PubChem CID11500
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC NameN-benzylacetamide
SMILESCC(=O)NCc1ccccc1
InChIInChI=1S/C9H11NO/c1-8(11)10-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,10,11)
InChIKeyUZJLYRRDVFWSGA-UHFFFAOYSA-N
XLogP1.32
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-Methylbenzylamine
CID 7669
Beclamide
CID 10391
N-Benzylformamide
CID 80654
N-(2-phenylethyl)acetamide
CID 70143
Tebutam
CID 92299
Formetamide
CID 65614
Melinamide
CID 20054967
Nebracetam
CID 65926
N-Propylbenzamide
CID 25354
Isopropylbenzylamine
CID 66024
N-Ethylbenzylamine
CID 84352
N-(1,1-Dimethylethyl)benzenemethanamine
CID 76908

Frequently Asked Questions

What is the IUPAC name of N-benzylacetamide?
The IUPAC name of N-benzylacetamide (CID 11500) is N-benzylacetamide.
What is the SMILES notation for N-benzylacetamide?
The canonical SMILES for N-benzylacetamide is CC(=O)NCc1ccccc1.
What is the InChIKey of N-benzylacetamide?
The InChIKey is UZJLYRRDVFWSGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-8(11)10-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,10,11).
What are the key properties of N-benzylacetamide?
N-benzylacetamide has a molecular weight of 149.19 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzylacetamide is sourced from PubChem (CID 11500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).