N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide

C15H15N3O2 — CID 24983131

IUPACN-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCc1ccnc(NC(=O)CNC(=O)c2ccccc2)c1
InChIInChI=1S/C15H15N3O2/c1-11-7-8-16-13(9-11)18-14(19)10-17-15(20)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,20)(H,16,18,19)
InChIKeyBWGHTMOBOBTOJO-UHFFFAOYSA-N
MW269.30 g/mol
LogP1.76
Rot. Bonds4

About N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide

N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide (PubChem CID 24983131) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
PubChem CID24983131
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCc1ccnc(NC(=O)CNC(=O)c2ccccc2)c1
InChIInChI=1S/C15H15N3O2/c1-11-7-8-16-13(9-11)18-14(19)10-17-15(20)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,20)(H,16,18,19)
InChIKeyBWGHTMOBOBTOJO-UHFFFAOYSA-N
XLogP1.76
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide (CID 24983131) is N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide is Cc1ccnc(NC(=O)CNC(=O)c2ccccc2)c1.
What is the InChIKey of N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
The InChIKey is BWGHTMOBOBTOJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-11-7-8-16-13(9-11)18-14(19)10-17-15(20)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,20)(H,16,18,19).
What are the key properties of N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide has a molecular weight of 269.30 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 24983131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).