N-(3-phenylbutyl)benzamide

C17H19NO — CID 62403316

IUPACN-(3-phenylbutyl)benzamide
SMILESCC(CCNC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO/c1-14(15-8-4-2-5-9-15)12-13-18-17(19)16-10-6-3-7-11-16/h2-11,14H,12-13H2,1H3,(H,18,19)
InChIKeyKVULULOZTZZGOR-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.61
Rot. Bonds5

About N-(3-phenylbutyl)benzamide

N-(3-phenylbutyl)benzamide (PubChem CID 62403316) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is N-(3-phenylbutyl)benzamide.

Molecular Properties

Compound NameN-(3-phenylbutyl)benzamide
PubChem CID62403316
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC NameN-(3-phenylbutyl)benzamide
SMILESCC(CCNC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO/c1-14(15-8-4-2-5-9-15)12-13-18-17(19)16-10-6-3-7-11-16/h2-11,14H,12-13H2,1H3,(H,18,19)
InChIKeyKVULULOZTZZGOR-UHFFFAOYSA-N
XLogP3.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(methylamino)-N-(3-phenylbutyl)benzamide
CID 62987359
N-(3-phenylbutyl)-2-sulfanylbenzamide
CID 107028920
3,4,5-trimethoxy-N-(3-phenylbutyl)benzamide
CID 110357561
1-N,4-N-bis(3,3-diphenylpropyl)benzene-1,4-dicarboxamide
CID 5181795
N-(4-hydroxy-3-methylbutyl)benzamide
CID 130383332
N-(3-amino-3-phenylpropyl)benzamide
CID 80506685
4-bromo-3-fluoro-N-(3-phenylbutyl)benzamide
CID 63525833
N-(3,3-diphenylpropyl)-4-methylbenzamide
CID 1312769
N-[2-[[(3S)-3-phenylbutyl]carbamoylamino]ethyl]acetamide
CID 125145755
4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(3S)-3-phenylbutyl]benzamide
CID 95869297
1-butyl-3-(3-phenylbutyl)urea
CID 115600283
3-amino-N-(3-phenylbutyl)pyridine-2-carboxamide
CID 104742250

Frequently Asked Questions

What is the IUPAC name of N-(3-phenylbutyl)benzamide?
The IUPAC name of N-(3-phenylbutyl)benzamide (CID 62403316) is N-(3-phenylbutyl)benzamide.
What is the SMILES notation for N-(3-phenylbutyl)benzamide?
The canonical SMILES for N-(3-phenylbutyl)benzamide is CC(CCNC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3-phenylbutyl)benzamide?
The InChIKey is KVULULOZTZZGOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-14(15-8-4-2-5-9-15)12-13-18-17(19)16-10-6-3-7-11-16/h2-11,14H,12-13H2,1H3,(H,18,19).
What are the key properties of N-(3-phenylbutyl)benzamide?
N-(3-phenylbutyl)benzamide has a molecular weight of 253.35 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenylbutyl)benzamide is sourced from PubChem (CID 62403316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).