1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide

C17H23N5O — CID 127758471

IUPAC1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide
SMILESCc1cc(C(=O)NC2CCCc3cn[nH]c32)nn1C(C)C1CC1
InChIInChI=1S/C17H23N5O/c1-10-8-15(21-22(10)11(2)12-6-7-12)17(23)19-14-5-3-4-13-9-18-20-16(13)14/h8-9,11-12,14H,3-7H2,1-2H3,(H,18,20)(H,19,23)
InChIKeyVVDPQUCDSPBNMI-UHFFFAOYSA-N
MW313.41 g/mol
LogP2.69
Rot. Bonds4

About 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide

1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide (PubChem CID 127758471) has the molecular formula C17H23N5O and a molecular weight of 313.41 g/mol. Its IUPAC name is 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide
PubChem CID127758471
Molecular FormulaC17H23N5O
Molecular Weight313.41 g/mol
Exact Mass313.19
IUPAC Name1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide
SMILESCc1cc(C(=O)NC2CCCc3cn[nH]c32)nn1C(C)C1CC1
InChIInChI=1S/C17H23N5O/c1-10-8-15(21-22(10)11(2)12-6-7-12)17(23)19-14-5-3-4-13-9-18-20-16(13)14/h8-9,11-12,14H,3-7H2,1-2H3,(H,18,20)(H,19,23)
InChIKeyVVDPQUCDSPBNMI-UHFFFAOYSA-N
XLogP2.69
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.41
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide?
The IUPAC name of 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide (CID 127758471) is 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide?
The canonical SMILES for 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide is Cc1cc(C(=O)NC2CCCc3cn[nH]c32)nn1C(C)C1CC1.
What is the InChIKey of 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide?
The InChIKey is VVDPQUCDSPBNMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O/c1-10-8-15(21-22(10)11(2)12-6-7-12)17(23)19-14-5-3-4-13-9-18-20-16(13)14/h8-9,11-12,14H,3-7H2,1-2H3,(H,18,20)(H,19,23).
What are the key properties of 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide?
1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide has a molecular weight of 313.41 g/mol, XLogP of 2.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylethyl)-5-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 127758471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).