5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide

C16H14N8O — CID 3239717

IUPAC5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCC1=C(C(=O)Nc2ccccn2)C(c2cccnc2)n2nnnc2N1
InChIInChI=1S/C16H14N8O/c1-10-13(15(25)20-12-6-2-3-8-18-12)14(11-5-4-7-17-9-11)24-16(19-10)21-22-23-24/h2-9,14H,1H3,(H,18,20,25)(H,19,21,23)
InChIKeyMWYOTSASSPYXDS-UHFFFAOYSA-N
MW334.34 g/mol
LogP1.39
Rot. Bonds3

About 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide

5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide (PubChem CID 3239717) has the molecular formula C16H14N8O and a molecular weight of 334.34 g/mol. Its IUPAC name is 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
PubChem CID3239717
Molecular FormulaC16H14N8O
Molecular Weight334.34 g/mol
Exact Mass334.13
IUPAC Name5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCC1=C(C(=O)Nc2ccccn2)C(c2cccnc2)n2nnnc2N1
InChIInChI=1S/C16H14N8O/c1-10-13(15(25)20-12-6-2-3-8-18-12)14(11-5-4-7-17-9-11)24-16(19-10)21-22-23-24/h2-9,14H,1H3,(H,18,20,25)(H,19,21,23)
InChIKeyMWYOTSASSPYXDS-UHFFFAOYSA-N
XLogP1.39
TPSA110.51 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.34
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-(pyridin-3-yl)pyrimidin-4-yl]acetamide
CID 25138073
2,6-dimethyl-3-N,5-N-dipyridin-2-yl-4-(1H-pyrrol-2-yl)-1,4-dihydropyridine-3,5-dicarboxamide
CID 46855303
2-(2-Dodecyl-2H-tetrazol-5-yl)-2-phenyl-N-pyridin-2-yl-acetamide
CID 10114711
2-(2-Dodecyl-2H-tetrazol-5-yl)-N-(3-methyl-pyridin-2-yl)-2-phenyl-acetamide
CID 10298395
N-[5-(isopropylamino)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyridin-2-yl]nicotinamide
CID 59437537
4-anilino-6-(ethylcarbamoylamino)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]pyridine-3-carboxamide
CID 71621004
N-(2-methylphenyl)-6-(1H-1,2,4-triazol-1-yl)nicotinamide
CID 1478849
2-(3-hydroxypropyl)-5-methyl-N-(2-methylphenyl)-7-(3-pyridinyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
CID 2947392
N,N-diethyl-5-methyl-7-(3-pyridinyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
CID 2983610
7-(4-fluorophenyl)-5-methyl-N-pyridin-2-yl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
CID 2998230
5-Methyl-2-(3-methylphenyl)-7-pyridin-3-yl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
CID 3239147
5-methyl-7-pyridin-2-yl-N-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
CID 3240320

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide?
The IUPAC name of 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide (CID 3239717) is 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide?
The canonical SMILES for 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide is CC1=C(C(=O)Nc2ccccn2)C(c2cccnc2)n2nnnc2N1.
What is the InChIKey of 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide?
The InChIKey is MWYOTSASSPYXDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N8O/c1-10-13(15(25)20-12-6-2-3-8-18-12)14(11-5-4-7-17-9-11)24-16(19-10)21-22-23-24/h2-9,14H,1H3,(H,18,20,25)(H,19,21,23).
What are the key properties of 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide?
5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide has a molecular weight of 334.34 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-pyridin-2-yl-7-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 3239717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).