N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide

C16H14N4O — CID 35505245

IUPACN-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide
SMILESCc1cccc(NC(=O)c2ccc(-n3cccn3)cc2)n1
InChIInChI=1S/C16H14N4O/c1-12-4-2-5-15(18-12)19-16(21)13-6-8-14(9-7-13)20-11-3-10-17-20/h2-11H,1H3,(H,18,19,21)
InChIKeyNAOWDNMNEKAXDR-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.83
Rot. Bonds3

About N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide

N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide (PubChem CID 35505245) has the molecular formula C16H14N4O and a molecular weight of 278.31 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide
PubChem CID35505245
Molecular FormulaC16H14N4O
Molecular Weight278.31 g/mol
Exact Mass278.12
IUPAC NameN-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide
SMILESCc1cccc(NC(=O)c2ccc(-n3cccn3)cc2)n1
InChIInChI=1S/C16H14N4O/c1-12-4-2-5-15(18-12)19-16(21)13-6-8-14(9-7-13)20-11-3-10-17-20/h2-11H,1H3,(H,18,19,21)
InChIKeyNAOWDNMNEKAXDR-UHFFFAOYSA-N
XLogP2.83
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-pyrazol-1-yl-N-pyridin-4-ylbenzamide
CID 27700232
4-(4-fluorophenoxy)-N-(6-methyl-2-pyridinyl)benzamide
CID 35505697
N-(6-methyl-2-pyridinyl)-4-(methylsulfanylmethyl)benzamide
CID 18107198
N-methyl-2-[(4-pyrazol-1-ylbenzoyl)amino]benzamide
CID 43020845
N-(2-ethylphenyl)-4-pyrazol-1-ylbenzamide
CID 2992386
N-(4-bromo-2-methylphenyl)-4-pyrazol-1-ylbenzamide
CID 71758813
3,4-diamino-N-(6-methyl-2-pyridinyl)benzamide
CID 22411201
N-(3,5-dichlorophenyl)-4-pyrazol-1-ylbenzamide
CID 46813346
N-(1H-imidazol-2-yl)-4-pyrazol-1-ylbenzamide
CID 60968230
N-(3-methoxy-1H-1,2,4-triazol-5-yl)-4-pyrazol-1-ylbenzamide
CID 83090123
3-methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 966005
propan-2-yl 4-[(4-pyrazol-1-ylbenzoyl)amino]benzoate
CID 17497737

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide (CID 35505245) is N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide is Cc1cccc(NC(=O)c2ccc(-n3cccn3)cc2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide?
The InChIKey is NAOWDNMNEKAXDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O/c1-12-4-2-5-15(18-12)19-16(21)13-6-8-14(9-7-13)20-11-3-10-17-20/h2-11H,1H3,(H,18,19,21).
What are the key properties of N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide?
N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide has a molecular weight of 278.31 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-4-pyrazol-1-ylbenzamide is sourced from PubChem (CID 35505245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).