5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide

C19H27N5O — CID 146042455

IUPAC5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide
SMILESCc1nn(C)c2c1C(NC(=O)c1cn[nH]c1C1CCCCC1)CCC2
InChIInChI=1S/C19H27N5O/c1-12-17-15(9-6-10-16(17)24(2)23-12)21-19(25)14-11-20-22-18(14)13-7-4-3-5-8-13/h11,13,15H,3-10H2,1-2H3,(H,20,22)(H,21,25)
InChIKeyAARBEVOOFVIUKH-UHFFFAOYSA-N
MW341.46 g/mol
LogP3.31
Rot. Bonds3

About 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide

5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide (PubChem CID 146042455) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide
PubChem CID146042455
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC Name5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide
SMILESCc1nn(C)c2c1C(NC(=O)c1cn[nH]c1C1CCCCC1)CCC2
InChIInChI=1S/C19H27N5O/c1-12-17-15(9-6-10-16(17)24(2)23-12)21-19(25)14-11-20-22-18(14)13-7-4-3-5-8-13/h11,13,15H,3-10H2,1-2H3,(H,20,22)(H,21,25)
InChIKeyAARBEVOOFVIUKH-UHFFFAOYSA-N
XLogP3.31
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine
CID 83861915
N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 154563605
N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
CID 146044826
N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-3-fluoro-6-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 146038471
N-[(3aR,5S,6S,7aS)-6-hydroxy-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-5-yl]-5-cyclohexyl-1H-pyrazole-4-carboxamide
CID 172657705
3-(benzenesulfonyl)-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)propanamide
CID 146038147
(5-cyclohexyl-1H-pyrazol-4-yl)-[(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methanone
CID 97152845
5-cyclohexyl-N-[2-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]-1H-pyrazole-4-carboxamide
CID 70770435
5-cyclohexyl-N-[(2R,3S,4S)-3-hydroxy-2-(hydroxymethyl)oxan-4-yl]-1H-pyrazole-4-carboxamide
CID 154566671
methyl 4-(5-cyclohexyl-1H-pyrazole-4-carbonyl)piperazine-1-carboxylate
CID 70755411
5-cyclohexyl-N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-yl]-1H-pyrazole-4-carboxamide
CID 131914240
N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-4-methyl-2-oxo-1-(3-propan-2-ylphenyl)pyridine-3-carboxamide
CID 172666690

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide (CID 146042455) is 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide is Cc1nn(C)c2c1C(NC(=O)c1cn[nH]c1C1CCCCC1)CCC2.
What is the InChIKey of 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide?
The InChIKey is AARBEVOOFVIUKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c1-12-17-15(9-6-10-16(17)24(2)23-12)21-19(25)14-11-20-22-18(14)13-7-4-3-5-8-13/h11,13,15H,3-10H2,1-2H3,(H,20,22)(H,21,25).
What are the key properties of 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide?
5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide has a molecular weight of 341.46 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-N-(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 146042455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).