N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide

C14H15N3O — CID 82343825

IUPACN-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cccc(CN)n1
InChIInChI=1S/C14H15N3O/c1-10-5-2-3-7-12(10)14(18)17-13-8-4-6-11(9-15)16-13/h2-8H,9,15H2,1H3,(H,16,17,18)
InChIKeyHTVKMMSPBIRFAM-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.10
Rot. Bonds3

About N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide

N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide (PubChem CID 82343825) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide
PubChem CID82343825
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cccc(CN)n1
InChIInChI=1S/C14H15N3O/c1-10-5-2-3-7-12(10)14(18)17-13-8-4-6-11(9-15)16-13/h2-8H,9,15H2,1H3,(H,16,17,18)
InChIKeyHTVKMMSPBIRFAM-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

N-[6-(aminomethyl)-2-pyridinyl]-3-methylbutanamide
CID 82343819
N-[6-(aminomethyl)-2-pyridinyl]-2-(dimethylamino)acetamide
CID 165487357
2-methyl-N-(4-methylpyrimidin-2-yl)benzamide
CID 132962288
2-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 87041318
N-[6-(aminomethyl)-2-pyridinyl]-3,4-dimethoxybenzamide
CID 82343837
1-[6-(aminomethyl)-2-pyridinyl]-3-(2-methylpropyl)urea
CID 165487408
N-[6-(aminomethyl)-2-pyridinyl]-4-oxo-4-phenylbutanamide
CID 82343885
1-N,3-N,5-N-tris(6-ethyl-2-pyridinyl)benzene-1,3,5-tricarboxamide
CID 11329889
N-(5-chloro-2-pyridinyl)-2-methylbenzamide
CID 758009
N-[5-(aminomethyl)-2-pyridinyl]-2-fluoro-3-methylbenzamide
CID 81481667
1-[6-(aminomethyl)-2-pyridinyl]-3-butylurea
CID 165487363
N-[6-(hydroxymethyl)-2-pyridinyl]benzamide
CID 82343745

Frequently Asked Questions

What is the IUPAC name of N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide?
The IUPAC name of N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide (CID 82343825) is N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide.
What is the SMILES notation for N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide?
The canonical SMILES for N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide is Cc1ccccc1C(=O)Nc1cccc(CN)n1.
What is the InChIKey of N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide?
The InChIKey is HTVKMMSPBIRFAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10-5-2-3-7-12(10)14(18)17-13-8-4-6-11(9-15)16-13/h2-8H,9,15H2,1H3,(H,16,17,18).
What are the key properties of N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide?
N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide 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 N-[6-(aminomethyl)-2-pyridinyl]-2-methylbenzamide is sourced from PubChem (CID 82343825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).