N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide

C13H16N4OS — CID 166217899

IUPACN-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
SMILESCCc1cnc(NC(=O)C2CCCc3[nH]ncc32)s1
InChIInChI=1S/C13H16N4OS/c1-2-8-6-14-13(19-8)16-12(18)9-4-3-5-11-10(9)7-15-17-11/h6-7,9H,2-5H2,1H3,(H,15,17)(H,14,16,18)
InChIKeyXKMKTAVSYVQPTI-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.49
Rot. Bonds3

About N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide

N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide (PubChem CID 166217899) has the molecular formula C13H16N4OS and a molecular weight of 276.36 g/mol. Its IUPAC name is N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide.

Molecular Properties

Compound NameN-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
PubChem CID166217899
Molecular FormulaC13H16N4OS
Molecular Weight276.36 g/mol
Exact Mass276.10
IUPAC NameN-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
SMILESCCc1cnc(NC(=O)C2CCCc3[nH]ncc32)s1
InChIInChI=1S/C13H16N4OS/c1-2-8-6-14-13(19-8)16-12(18)9-4-3-5-11-10(9)7-15-17-11/h6-7,9H,2-5H2,1H3,(H,15,17)(H,14,16,18)
InChIKeyXKMKTAVSYVQPTI-UHFFFAOYSA-N
XLogP2.49
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(6S)-N-(5-piperidin-4-yl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-6-carboxamide
CID 164636387
N-(5-propyl-1,3-thiazol-2-yl)-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole-5-carboxamide
CID 132304720
N-(5-cyano-1,3-thiazol-2-yl)-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole-5-carboxamide
CID 167958493
3-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 49669603
3-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(5-methyl-1,3-thiazol-3-ium-2-yl)propanamide
CID 140917530
N-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 71971062
(4R)-N-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 97599026
(4S)-N-[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 97599028
5-(2-cyclohexylacetyl)-2-methyl-N-(1,3-thiazol-2-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide
CID 110084953
N-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 110674219
N-(5-methyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
CID 120464275
N-(5-methyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 120464276

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide?
The IUPAC name of N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide (CID 166217899) is N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide.
What is the SMILES notation for N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide?
The canonical SMILES for N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide is CCc1cnc(NC(=O)C2CCCc3[nH]ncc32)s1.
What is the InChIKey of N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide?
The InChIKey is XKMKTAVSYVQPTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4OS/c1-2-8-6-14-13(19-8)16-12(18)9-4-3-5-11-10(9)7-15-17-11/h6-7,9H,2-5H2,1H3,(H,15,17)(H,14,16,18).
What are the key properties of N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide?
N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide has a molecular weight of 276.36 g/mol, XLogP of 2.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide is sourced from PubChem (CID 166217899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).