N-(3-amino-3-phenylpropyl)benzamide

C16H18N2O — CID 80506685

IUPACN-(3-amino-3-phenylpropyl)benzamide
SMILESNC(CCNC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18N2O/c17-15(13-7-3-1-4-8-13)11-12-18-16(19)14-9-5-2-6-10-14/h1-10,15H,11-12,17H2,(H,18,19)
InChIKeyBKAZCYNGFFAAAM-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.51
Rot. Bonds5

About N-(3-amino-3-phenylpropyl)benzamide

N-(3-amino-3-phenylpropyl)benzamide (PubChem CID 80506685) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-(3-amino-3-phenylpropyl)benzamide.

Molecular Properties

Compound NameN-(3-amino-3-phenylpropyl)benzamide
PubChem CID80506685
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-(3-amino-3-phenylpropyl)benzamide
SMILESNC(CCNC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18N2O/c17-15(13-7-3-1-4-8-13)11-12-18-16(19)14-9-5-2-6-10-14/h1-10,15H,11-12,17H2,(H,18,19)
InChIKeyBKAZCYNGFFAAAM-UHFFFAOYSA-N
XLogP2.51
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-3-phenylpropyl)-3,5-dihydroxybenzamide
CID 107705147
N-(3-amino-3-phenylpropyl)-3-fluorobenzamide
CID 80506781
N-(3-amino-3-phenylpropyl)-3-bromobenzamide
CID 80506719
N-(3-amino-3-phenylpropyl)-3-hydroxy-4-methylbenzamide
CID 80507148
1-N,4-N-bis(3,3-diphenylpropyl)benzene-1,4-dicarboxamide
CID 5181795
N-(3-amino-3-phenylpropyl)-2-ethylbutanamide
CID 80506593
N-(3-phenylbutyl)benzamide
CID 62403316
N-(3-amino-3-phenylpropyl)-4-chloro-3-fluorobenzamide
CID 107990677
N-(3-amino-3-phenylpropyl)thiophene-2-carboxamide
CID 80506792
N-(3-amino-3-phenylpropyl)-2,5-dichlorobenzamide
CID 80507130
N-(3-amino-3-phenylpropyl)cyclopropanecarboxamide
CID 80506627
N-(3-amino-3-phenylpropyl)-3-bromothiophene-2-carboxamide
CID 80506518

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-3-phenylpropyl)benzamide?
The IUPAC name of N-(3-amino-3-phenylpropyl)benzamide (CID 80506685) is N-(3-amino-3-phenylpropyl)benzamide.
What is the SMILES notation for N-(3-amino-3-phenylpropyl)benzamide?
The canonical SMILES for N-(3-amino-3-phenylpropyl)benzamide is NC(CCNC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3-amino-3-phenylpropyl)benzamide?
The InChIKey is BKAZCYNGFFAAAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c17-15(13-7-3-1-4-8-13)11-12-18-16(19)14-9-5-2-6-10-14/h1-10,15H,11-12,17H2,(H,18,19).
What are the key properties of N-(3-amino-3-phenylpropyl)benzamide?
N-(3-amino-3-phenylpropyl)benzamide has a molecular weight of 254.33 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-3-phenylpropyl)benzamide is sourced from PubChem (CID 80506685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).