4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide

C14H15N3O — CID 63326435

IUPAC4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide
SMILESCc1ccncc1NC(=O)c1ccc(CN)cc1
InChIInChI=1S/C14H15N3O/c1-10-6-7-16-9-13(10)17-14(18)12-4-2-11(8-15)3-5-12/h2-7,9H,8,15H2,1H3,(H,17,18)
InChIKeyYAPYKRRNLGDSLQ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.10
Rot. Bonds3

About 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide

4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide (PubChem CID 63326435) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide.

Molecular Properties

Compound Name4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide
PubChem CID63326435
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide
SMILESCc1ccncc1NC(=O)c1ccc(CN)cc1
InChIInChI=1S/C14H15N3O/c1-10-6-7-16-9-13(10)17-14(18)12-4-2-11(8-15)3-5-12/h2-7,9H,8,15H2,1H3,(H,17,18)
InChIKeyYAPYKRRNLGDSLQ-UHFFFAOYSA-N
XLogP2.10
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
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

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Related Compounds

4-(aminomethyl)-N-(2,4,5-trimethylphenyl)benzamide
CID 115161218
3-(chloromethyl)-N-(4-methyl-3-pyridinyl)benzamide
CID 63327302
N-[5-[[4-(aminomethyl)phenyl]methylcarbamoyl]-2-methylphenyl]pyridine-3-carboxamide
CID 23906553
4-(aminomethyl)-N-pyridin-3-ylbenzamide
CID 16774572
1,3-bis(4-methyl-3-pyridinyl)urea
CID 86818735
N-[5-(aminomethyl)-2-methylphenyl]-4-ethylbenzamide
CID 62103960
3,4,5-trifluoro-N-(4-methyl-3-pyridinyl)benzamide
CID 63327399
5-(aminomethyl)-N-(3-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 63723889
N-(3-amino-4-pyridinyl)-4-ethylbenzamide
CID 63062261
2,6-difluoro-N-(4-methyl-3-pyridinyl)benzamide
CID 155976888
2-fluoro-N-(4-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 55203428
4-(aminomethyl)-N-(1,3-dimethylpyrazol-4-yl)benzamide
CID 103796977

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide?
The IUPAC name of 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide (CID 63326435) is 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide.
What is the SMILES notation for 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide?
The canonical SMILES for 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide is Cc1ccncc1NC(=O)c1ccc(CN)cc1.
What is the InChIKey of 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide?
The InChIKey is YAPYKRRNLGDSLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10-6-7-16-9-13(10)17-14(18)12-4-2-11(8-15)3-5-12/h2-7,9H,8,15H2,1H3,(H,17,18).
What are the key properties of 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide?
4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide has a molecular weight of 241.29 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide is sourced from PubChem (CID 63326435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).