benzamide;pyridine-4-carboxamide

C13H13N3O2 — CID 175267661

IUPACbenzamide;pyridine-4-carboxamide
SMILESNC(=O)c1ccccc1.NC(=O)c1ccncc1
InChIInChI=1S/C7H7NO.C6H6N2O/c8-7(9)6-4-2-1-3-5-6;7-6(9)5-1-3-8-4-2-5/h1-5H,(H2,8,9);1-4H,(H2,7,9)
InChIKeyDKCMINZHUUZJJG-UHFFFAOYSA-N
MW243.27 g/mol
LogP0.97
Rot. Bonds2

About benzamide;pyridine-4-carboxamide

benzamide;pyridine-4-carboxamide (PubChem CID 175267661) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is benzamide;pyridine-4-carboxamide.

Molecular Properties

Compound Namebenzamide;pyridine-4-carboxamide
PubChem CID175267661
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Namebenzamide;pyridine-4-carboxamide
SMILESNC(=O)c1ccccc1.NC(=O)c1ccncc1
InChIInChI=1S/C7H7NO.C6H6N2O/c8-7(9)6-4-2-1-3-5-6;7-6(9)5-1-3-8-4-2-5/h1-5H,(H2,8,9);1-4H,(H2,7,9)
InChIKeyDKCMINZHUUZJJG-UHFFFAOYSA-N
XLogP0.97
TPSA99.07 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

benzamide;pyrazine
CID 67119172
pyridine;pyridine-4-carboxamide
CID 70513287
hydrazine;pyridine-4-carboxamide;hydrate
CID 170336563
propan-2-one;pyridine-4-carboxamide
CID 174689468
benzamide;hydron
CID 68819060
CID 67738089
CID 67738089
benzamide;ethene
CID 143479548
copper;acetic acid;bis(pyridine-4-carboxamide);diacetate
CID 139155367
nonanedioic acid;bis(pyridine-4-carboxamide)
CID 139205511
zinc;bis(pyridine-4-carboxamide);diisothiocyanate
CID 139088078
dipotassium;benzamide;carbonate
CID 159256468
benzamide;dimethyltin
CID 174591280

Frequently Asked Questions

What is the IUPAC name of benzamide;pyridine-4-carboxamide?
The IUPAC name of benzamide;pyridine-4-carboxamide (CID 175267661) is benzamide;pyridine-4-carboxamide.
What is the SMILES notation for benzamide;pyridine-4-carboxamide?
The canonical SMILES for benzamide;pyridine-4-carboxamide is NC(=O)c1ccccc1.NC(=O)c1ccncc1.
What is the InChIKey of benzamide;pyridine-4-carboxamide?
The InChIKey is DKCMINZHUUZJJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NO.C6H6N2O/c8-7(9)6-4-2-1-3-5-6;7-6(9)5-1-3-8-4-2-5/h1-5H,(H2,8,9);1-4H,(H2,7,9).
What are the key properties of benzamide;pyridine-4-carboxamide?
benzamide;pyridine-4-carboxamide has a molecular weight of 243.27 g/mol, XLogP of 0.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzamide;pyridine-4-carboxamide is sourced from PubChem (CID 175267661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).