N-(3-aminopropyl)-N-(2-methylphenyl)benzamide

C17H20N2O — CID 28766808

IUPACN-(3-aminopropyl)-N-(2-methylphenyl)benzamide
SMILESCc1ccccc1N(CCCN)C(=O)c1ccccc1
InChIInChI=1S/C17H20N2O/c1-14-8-5-6-11-16(14)19(13-7-12-18)17(20)15-9-3-2-4-10-15/h2-6,8-11H,7,12-13,18H2,1H3
InChIKeyTUAMRBMGZBQVCG-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.99
Rot. Bonds5

About N-(3-aminopropyl)-N-(2-methylphenyl)benzamide

N-(3-aminopropyl)-N-(2-methylphenyl)benzamide (PubChem CID 28766808) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-(2-methylphenyl)benzamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-(2-methylphenyl)benzamide
PubChem CID28766808
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-(3-aminopropyl)-N-(2-methylphenyl)benzamide
SMILESCc1ccccc1N(CCCN)C(=O)c1ccccc1
InChIInChI=1S/C17H20N2O/c1-14-8-5-6-11-16(14)19(13-7-12-18)17(20)15-9-3-2-4-10-15/h2-6,8-11H,7,12-13,18H2,1H3
InChIKeyTUAMRBMGZBQVCG-UHFFFAOYSA-N
XLogP2.99
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxyethyl)-N-(2-methylphenyl)benzamide
CID 91188754
1-(3-aminopropyl)-3-ethyl-1-(2-methylphenyl)urea
CID 43164862
N-(3-aminopropyl)-3-methyl-N-(2-methylphenyl)butanamide
CID 28766792
1-(3-aminopropyl)-3-butyl-1-(2-methylphenyl)urea
CID 43318701
N-(4-aminobutyl)-N-methylbenzamide
CID 119088367
N-(3-aminopropyl)-1,5-dimethyl-N-(2-methylphenyl)pyrazole-4-carboxamide
CID 43318651
N-(3-aminopropyl)-N-(2-methylphenyl)cycloheptanecarboxamide
CID 62586297
N-(3-aminopropyl)-N-(2-methylphenyl)-2-propoxyacetamide
CID 107937233
N-(3-amino-3-oxopropyl)-N-(2-fluoro-3-methylphenyl)benzamide
CID 130328320
N,N-bis(6-aminohexyl)benzamide
CID 68737596
N-(2-aminoethyl)-N-methylbenzamide
CID 28707416
1-(2-hydroxyethyl)-1-(2-methylphenyl)urea
CID 14685232

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-(2-methylphenyl)benzamide?
The IUPAC name of N-(3-aminopropyl)-N-(2-methylphenyl)benzamide (CID 28766808) is N-(3-aminopropyl)-N-(2-methylphenyl)benzamide.
What is the SMILES notation for N-(3-aminopropyl)-N-(2-methylphenyl)benzamide?
The canonical SMILES for N-(3-aminopropyl)-N-(2-methylphenyl)benzamide is Cc1ccccc1N(CCCN)C(=O)c1ccccc1.
What is the InChIKey of N-(3-aminopropyl)-N-(2-methylphenyl)benzamide?
The InChIKey is TUAMRBMGZBQVCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-14-8-5-6-11-16(14)19(13-7-12-18)17(20)15-9-3-2-4-10-15/h2-6,8-11H,7,12-13,18H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-(2-methylphenyl)benzamide?
N-(3-aminopropyl)-N-(2-methylphenyl)benzamide has a molecular weight of 268.36 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-(2-methylphenyl)benzamide is sourced from PubChem (CID 28766808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).