N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide

C19H22N2O2 — CID 119627671

IUPACN-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide
SMILESCc1ccc(C(=O)c2ccccc2C(=O)NCC(C)(C)N)cc1
InChIInChI=1S/C19H22N2O2/c1-13-8-10-14(11-9-13)17(22)15-6-4-5-7-16(15)18(23)21-12-19(2,3)20/h4-11H,12,20H2,1-3H3,(H,21,23)
InChIKeyBGVAIHMAAIXKJH-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.69
Rot. Bonds5

About N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide

N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide (PubChem CID 119627671) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide
PubChem CID119627671
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide
SMILESCc1ccc(C(=O)c2ccccc2C(=O)NCC(C)(C)N)cc1
InChIInChI=1S/C19H22N2O2/c1-13-8-10-14(11-9-13)17(22)15-6-4-5-7-16(15)18(23)21-12-19(2,3)20/h4-11H,12,20H2,1-3H3,(H,21,23)
InChIKeyBGVAIHMAAIXKJH-UHFFFAOYSA-N
XLogP2.69
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide (CID 119627671) is N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide is Cc1ccc(C(=O)c2ccccc2C(=O)NCC(C)(C)N)cc1.
What is the InChIKey of N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide?
The InChIKey is BGVAIHMAAIXKJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-13-8-10-14(11-9-13)17(22)15-6-4-5-7-16(15)18(23)21-12-19(2,3)20/h4-11H,12,20H2,1-3H3,(H,21,23).
What are the key properties of N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide?
N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide has a molecular weight of 310.40 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-2-(4-methylbenzoyl)benzamide is sourced from PubChem (CID 119627671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).