N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide

C14H15N3O — CID 55063231

IUPACN-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(CN)cn2)cc1
InChIInChI=1S/C14H15N3O/c1-10-2-5-12(6-3-10)14(18)17-13-7-4-11(8-15)9-16-13/h2-7,9H,8,15H2,1H3,(H,16,17,18)
InChIKeyJZYFEGMZOFKENY-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.10
Rot. Bonds3

About N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide

N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide (PubChem CID 55063231) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide
PubChem CID55063231
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(CN)cn2)cc1
InChIInChI=1S/C14H15N3O/c1-10-2-5-12(6-3-10)14(18)17-13-7-4-11(8-15)9-16-13/h2-7,9H,8,15H2,1H3,(H,16,17,18)
InChIKeyJZYFEGMZOFKENY-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-[5-(aminomethyl)-2-pyridinyl]-2-fluoro-3-methylbenzamide
CID 81481667
N-[5-(aminomethyl)-2-pyridinyl]-3-methoxybenzamide
CID 62350444
4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide
CID 113023427
N-[5-[2-(4-chlorophenyl)ethylamino]-2-pyridinyl]-4-methylbenzamide
CID 113029009
N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide
CID 79095429
4-methyl-N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011759
4-(ethylamino)-N-(5-methyl-2-pyridinyl)benzamide
CID 62172642
4-methyl-N-[6-[(4-methylphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041076
4-methyl-N-[5-(3-methylbutylamino)-2-pyridinyl]benzamide
CID 113030264
N-(5-methyl-2-pyridinyl)-4-methylsulfonylbenzamide
CID 16583790
2-[[4-[2-(aminomethyl)phenyl]benzoyl]amino]-N-(5-chloro-2-pyridinyl)benzamide;2-[[4-[4-(aminomethyl)phenyl]benzoyl]amino]-N-(5-methyl-2-pyridinyl)benzamide
CID 160614519
tert-butyl N-[[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]methyl]carbamate
CID 17476260

Frequently Asked Questions

What is the IUPAC name of N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide?
The IUPAC name of N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide (CID 55063231) is N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide.
What is the SMILES notation for N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide?
The canonical SMILES for N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide is Cc1ccc(C(=O)Nc2ccc(CN)cn2)cc1.
What is the InChIKey of N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide?
The InChIKey is JZYFEGMZOFKENY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10-2-5-12(6-3-10)14(18)17-13-7-4-11(8-15)9-16-13/h2-7,9H,8,15H2,1H3,(H,16,17,18).
What are the key properties of N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide?
N-[5-(aminomethyl)-2-pyridinyl]-4-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-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide is sourced from PubChem (CID 55063231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).