5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide

C17H23N5O — CID 70747367

IUPAC5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide
SMILESO=C(NC1CCc2[nH]ncc2C1)c1cn[nH]c1C1CCCCC1
InChIInChI=1S/C17H23N5O/c23-17(20-13-6-7-15-12(8-13)9-18-21-15)14-10-19-22-16(14)11-4-2-1-3-5-11/h9-11,13H,1-8H2,(H,18,21)(H,19,22)(H,20,23)
InChIKeyKNFRHVXZFWIIEO-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.47
Rot. Bonds3

About 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide

5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide (PubChem CID 70747367) has the molecular formula C17H23N5O and a molecular weight of 313.40 g/mol. Its IUPAC name is 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide
PubChem CID70747367
Molecular FormulaC17H23N5O
Molecular Weight313.40 g/mol
Exact Mass313.19
IUPAC Name5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide
SMILESO=C(NC1CCc2[nH]ncc2C1)c1cn[nH]c1C1CCCCC1
InChIInChI=1S/C17H23N5O/c23-17(20-13-6-7-15-12(8-13)9-18-21-15)14-10-19-22-16(14)11-4-2-1-3-5-11/h9-11,13H,1-8H2,(H,18,21)(H,19,22)(H,20,23)
InChIKeyKNFRHVXZFWIIEO-UHFFFAOYSA-N
XLogP2.47
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide (CID 70747367) is 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide is O=C(NC1CCc2[nH]ncc2C1)c1cn[nH]c1C1CCCCC1.
What is the InChIKey of 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide?
The InChIKey is KNFRHVXZFWIIEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O/c23-17(20-13-6-7-15-12(8-13)9-18-21-15)14-10-19-22-16(14)11-4-2-1-3-5-11/h9-11,13H,1-8H2,(H,18,21)(H,19,22)(H,20,23).
What are the key properties of 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide?
5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 2.47, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 70747367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).