N-(2-aminophenyl)-N-propylbenzamide

C16H18N2O — CID 63230394

IUPACN-(2-aminophenyl)-N-propylbenzamide
SMILESCCCN(C(=O)c1ccccc1)c1ccccc1N
InChIInChI=1S/C16H18N2O/c1-2-12-18(15-11-7-6-10-14(15)17)16(19)13-8-4-3-5-9-13/h3-11H,2,12,17H2,1H3
InChIKeyADABHDQCXNNIFU-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.33
Rot. Bonds4

About N-(2-aminophenyl)-N-propylbenzamide

N-(2-aminophenyl)-N-propylbenzamide (PubChem CID 63230394) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-(2-aminophenyl)-N-propylbenzamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-N-propylbenzamide
PubChem CID63230394
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-(2-aminophenyl)-N-propylbenzamide
SMILESCCCN(C(=O)c1ccccc1)c1ccccc1N
InChIInChI=1S/C16H18N2O/c1-2-12-18(15-11-7-6-10-14(15)17)16(19)13-8-4-3-5-9-13/h3-11H,2,12,17H2,1H3
InChIKeyADABHDQCXNNIFU-UHFFFAOYSA-N
XLogP3.33
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-aminophenyl)-3-chloro-4-methyl-N-propylbenzamide
CID 63230488
N-(2-aminophenyl)-N-propylbutanamide
CID 63230657
1-(2-aminophenyl)-3-benzyl-1-propylurea
CID 107653018
N-(2-aminophenyl)-N-propylfuran-2-carboxamide
CID 63230481
N-(2-aminophenyl)-N-propylpyridine-2-carboxamide
CID 63230351
1-(2-aminophenyl)-3,3-diethyl-1-propylurea
CID 79154664
N-(2-aminophenyl)-3-ethyl-N-propylthiophene-2-carboxamide
CID 79985121
2-methylpropyl N-(2-aminophenyl)-N-propylcarbamate
CID 55173815
N-(2-aminophenyl)-4,5-dimethyl-N-propylthiophene-2-carboxamide
CID 65237112
N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide
CID 63230482
N-(2-aminophenyl)-5-fluoro-2-methyl-N-propylbenzamide
CID 63230448
N-(2-aminophenyl)-2-(4-fluorophenyl)-N-propylacetamide
CID 63230441

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-N-propylbenzamide?
The IUPAC name of N-(2-aminophenyl)-N-propylbenzamide (CID 63230394) is N-(2-aminophenyl)-N-propylbenzamide.
What is the SMILES notation for N-(2-aminophenyl)-N-propylbenzamide?
The canonical SMILES for N-(2-aminophenyl)-N-propylbenzamide is CCCN(C(=O)c1ccccc1)c1ccccc1N.
What is the InChIKey of N-(2-aminophenyl)-N-propylbenzamide?
The InChIKey is ADABHDQCXNNIFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-2-12-18(15-11-7-6-10-14(15)17)16(19)13-8-4-3-5-9-13/h3-11H,2,12,17H2,1H3.
What are the key properties of N-(2-aminophenyl)-N-propylbenzamide?
N-(2-aminophenyl)-N-propylbenzamide has a molecular weight of 254.33 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-N-propylbenzamide is sourced from PubChem (CID 63230394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).