4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide

C16H16N6OS — CID 95202854

IUPAC4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide
SMILESCc1nnsc1C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccn1
InChIInChI=1S/C16H16N6OS/c1-10-15(24-21-20-10)16(23)19-12-5-4-6-13-11(12)9-18-22(13)14-7-2-3-8-17-14/h2-3,7-9,12H,4-6H2,1H3,(H,19,23)/t12-/m1/s1
InChIKeyQCQPIRWDAOZPJV-GFCCVEGCSA-N
MW340.41 g/mol
LogP2.23
Rot. Bonds3

About 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide

4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide (PubChem CID 95202854) has the molecular formula C16H16N6OS and a molecular weight of 340.41 g/mol. Its IUPAC name is 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide
PubChem CID95202854
Molecular FormulaC16H16N6OS
Molecular Weight340.41 g/mol
Exact Mass340.11
IUPAC Name4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide
SMILESCc1nnsc1C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccn1
InChIInChI=1S/C16H16N6OS/c1-10-15(24-21-20-10)16(23)19-12-5-4-6-13-11(12)9-18-22(13)14-7-2-3-8-17-14/h2-3,7-9,12H,4-6H2,1H3,(H,19,23)/t12-/m1/s1
InChIKeyQCQPIRWDAOZPJV-GFCCVEGCSA-N
XLogP2.23
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.41
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide with MolForge

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Related Compounds

3-methyl-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiophene-2-carboxamide
CID 95384792
N-[(4R)-1-(3,5-difluorophenyl)-4,5,6,7-tetrahydroindazol-4-yl]-4-methylthiadiazole-5-carboxamide
CID 42245579
1,5-dimethyl-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]pyrazole-3-carboxamide
CID 95384756
5-chloro-1-methyl-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]pyrazole-3-carboxamide
CID 95384778
3-methoxy-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]benzamide
CID 95384794
3-methyl-N-(1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl)butanamide
CID 110225912
(2R)-2-methyl-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]butanamide
CID 95857278
1-ethyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]pyrazole-3-carboxamide
CID 95384965
2-(5-methylpyrazol-1-yl)-N-(1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl)propanamide
CID 56731383
3-(2-methyl-6-oxo-1-pyridinyl)-N-(1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl)propanamide
CID 72895125
5-(2-methylpropyl)-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]-1,2-oxazole-3-carboxamide
CID 97142495
5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide
CID 42095333

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide?
The IUPAC name of 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide (CID 95202854) is 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide is Cc1nnsc1C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccn1.
What is the InChIKey of 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide?
The InChIKey is QCQPIRWDAOZPJV-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H16N6OS/c1-10-15(24-21-20-10)16(23)19-12-5-4-6-13-11(12)9-18-22(13)14-7-2-3-8-17-14/h2-3,7-9,12H,4-6H2,1H3,(H,19,23)/t12-/m1/s1.
What are the key properties of 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide?
4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide has a molecular weight of 340.41 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]thiadiazole-5-carboxamide is sourced from PubChem (CID 95202854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).