N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide

C14H15N3O — CID 62899740

IUPACN-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(N)nc2)cc1C
InChIInChI=1S/C14H15N3O/c1-9-3-4-11(7-10(9)2)14(18)17-12-5-6-13(15)16-8-12/h3-8H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyKGVRTJSWHGKVSC-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.53
Rot. Bonds2

About N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide

N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide (PubChem CID 62899740) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide
PubChem CID62899740
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(N)nc2)cc1C
InChIInChI=1S/C14H15N3O/c1-9-3-4-11(7-10(9)2)14(18)17-12-5-6-13(15)16-8-12/h3-8H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyKGVRTJSWHGKVSC-UHFFFAOYSA-N
XLogP2.53
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(6-amino-3-pyridinyl)amino]propyl]-3,4-dimethylbenzamide
CID 82331662
N-(6-amino-3-pyridinyl)-4-iodobenzamide
CID 55132398
N-(6-amino-3-pyridinyl)-4-hydroxybenzamide
CID 62900503
N-(6-amino-3-pyridinyl)-4-bromo-2-methylbenzamide
CID 62901139
6-amino-N-(4-bromo-3-methylphenyl)pyridine-3-carboxamide
CID 55036943
3,4-dimethyl-N-(4-methylphenyl)benzamide
CID 3950718
6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide
CID 62059203
N-(6-amino-3-pyridinyl)-4-methyl-3-piperidin-1-ylsulfonylbenzamide;hydrochloride
CID 119516416
N-(6-amino-3-pyridinyl)-3-chlorobenzamide
CID 62899569
N-(4-acetamidophenyl)-6-aminopyridine-3-carboxamide
CID 110861506
N-[6-(butylamino)-3-pyridinyl]-3,4-dimethylbenzamide
CID 113009468
6-amino-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
CID 62060168

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide (CID 62899740) is N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide is Cc1ccc(C(=O)Nc2ccc(N)nc2)cc1C.
What is the InChIKey of N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide?
The InChIKey is KGVRTJSWHGKVSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-9-3-4-11(7-10(9)2)14(18)17-12-5-6-13(15)16-8-12/h3-8H,1-2H3,(H2,15,16)(H,17,18).
What are the key properties of N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide?
N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide has a molecular weight of 241.29 g/mol, XLogP of 2.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide is sourced from PubChem (CID 62899740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).