3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide

C14H15N3O — CID 103824002

IUPAC3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide
SMILESCc1cncc(NCc2cccc(C(N)=O)c2)c1
InChIInChI=1S/C14H15N3O/c1-10-5-13(9-16-7-10)17-8-11-3-2-4-12(6-11)14(15)18/h2-7,9,17H,8H2,1H3,(H2,15,18)
InChIKeyCBLOSDPNVOLGDG-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.10
Rot. Bonds4

About 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide

3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide (PubChem CID 103824002) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide.

Molecular Properties

Compound Name3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide
PubChem CID103824002
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide
SMILESCc1cncc(NCc2cccc(C(N)=O)c2)c1
InChIInChI=1S/C14H15N3O/c1-10-5-13(9-16-7-10)17-8-11-3-2-4-12(6-11)14(15)18/h2-7,9,17H,8H2,1H3,(H2,15,18)
InChIKeyCBLOSDPNVOLGDG-UHFFFAOYSA-N
XLogP2.10
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(3-bromo-4-methylanilino)methyl]benzamide
CID 55201932
3-[(2,4,6-trimethylanilino)methyl]benzamide
CID 63276989
3-[(4-tert-butylanilino)methyl]benzamide
CID 28572040
3-[[(6-methoxy-3-pyridinyl)amino]methyl]benzamide
CID 28564635
5-methyl-N-[(3-nitrophenyl)methyl]pyridin-3-amine
CID 75386276
3-[(3,5-dichloroanilino)methyl]benzamide
CID 28576195
3-[(3,5-difluoroanilino)methyl]benzamide
CID 28584265
3-[(2,4-dimethylanilino)methyl]benzamide
CID 28564440
3-[(3-methyl-4-nitroanilino)methyl]benzamide
CID 60969386
3-(pyridin-4-ylmethylamino)benzamide
CID 28650520
4-[(3-methylanilino)methyl]benzamide
CID 28564307
3-[[(6-tert-butylsulfonyl-3-pyridinyl)amino]methyl]benzamide
CID 133373609

Frequently Asked Questions

What is the IUPAC name of 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide?
The IUPAC name of 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide (CID 103824002) is 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide.
What is the SMILES notation for 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide?
The canonical SMILES for 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide is Cc1cncc(NCc2cccc(C(N)=O)c2)c1.
What is the InChIKey of 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide?
The InChIKey is CBLOSDPNVOLGDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10-5-13(9-16-7-10)17-8-11-3-2-4-12(6-11)14(15)18/h2-7,9,17H,8H2,1H3,(H2,15,18).
What are the key properties of 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide?
3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide has a molecular weight of 241.29 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide is sourced from PubChem (CID 103824002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).