2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide

C20H15N5OS — CID 75415459

IUPAC2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
SMILESCc1nc(-c2ccccc2)ccc1C(=O)Nc1nnc(-c2ccccn2)s1
InChIInChI=1S/C20H15N5OS/c1-13-15(10-11-16(22-13)14-7-3-2-4-8-14)18(26)23-20-25-24-19(27-20)17-9-5-6-12-21-17/h2-12H,1H3,(H,23,25,26)
InChIKeyPYDFWDMFCDBQCI-UHFFFAOYSA-N
MW373.44 g/mol
LogP4.22
Rot. Bonds4

About 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide

2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide (PubChem CID 75415459) has the molecular formula C20H15N5OS and a molecular weight of 373.44 g/mol. Its IUPAC name is 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
PubChem CID75415459
Molecular FormulaC20H15N5OS
Molecular Weight373.44 g/mol
Exact Mass373.10
IUPAC Name2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
SMILESCc1nc(-c2ccccc2)ccc1C(=O)Nc1nnc(-c2ccccn2)s1
InChIInChI=1S/C20H15N5OS/c1-13-15(10-11-16(22-13)14-7-3-2-4-8-14)18(26)23-20-25-24-19(27-20)17-9-5-6-12-21-17/h2-12H,1H3,(H,23,25,26)
InChIKeyPYDFWDMFCDBQCI-UHFFFAOYSA-N
XLogP4.22
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.44
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-methylphenyl)-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide
CID 55810221
N-(1,3-benzothiazol-2-yl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 27895592
4-chloro-2-iodo-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)benzamide
CID 55810604
2-methoxy-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 167988705
2-(2-methylpropoxy)-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 167890444
2-methyl-6-phenyl-N-quinolin-5-ylpyridine-3-carboxamide
CID 34130475
4-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pentanamide
CID 47251913
2-(dimethylamino)-2-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
CID 122134184
2-methyl-3-(methylamino)-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)propanamide;dihydrochloride
CID 119855733
N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)-2-(trifluoromethylsulfanyl)pyridine-3-carboxamide
CID 47857402
N-[2-(dimethylcarbamoyl)phenyl]-2-methyl-6-phenylpyridine-3-carboxamide
CID 39231573
N-[3-(carbamoylamino)phenyl]-2-methyl-6-phenylpyridine-3-carboxamide
CID 36823885

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide (CID 75415459) is 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide is Cc1nc(-c2ccccc2)ccc1C(=O)Nc1nnc(-c2ccccn2)s1.
What is the InChIKey of 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is PYDFWDMFCDBQCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5OS/c1-13-15(10-11-16(22-13)14-7-3-2-4-8-14)18(26)23-20-25-24-19(27-20)17-9-5-6-12-21-17/h2-12H,1H3,(H,23,25,26).
What are the key properties of 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 373.44 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-phenyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 75415459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).