5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide

C18H16N6O — CID 78866292

IUPAC5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide
SMILESCc1ccc2[nH]nc(C(=O)NCc3ccnc(-n4cccn4)c3)c2c1
InChIInChI=1S/C18H16N6O/c1-12-3-4-15-14(9-12)17(23-22-15)18(25)20-11-13-5-7-19-16(10-13)24-8-2-6-21-24/h2-10H,11H2,1H3,(H,20,25)(H,22,23)
InChIKeyNUXRFRLNRVSNNA-UHFFFAOYSA-N
MW332.37 g/mol
LogP2.38
Rot. Bonds4

About 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide

5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide (PubChem CID 78866292) has the molecular formula C18H16N6O and a molecular weight of 332.37 g/mol. Its IUPAC name is 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide
PubChem CID78866292
Molecular FormulaC18H16N6O
Molecular Weight332.37 g/mol
Exact Mass332.14
IUPAC Name5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide
SMILESCc1ccc2[nH]nc(C(=O)NCc3ccnc(-n4cccn4)c3)c2c1
InChIInChI=1S/C18H16N6O/c1-12-3-4-15-14(9-12)17(23-22-15)18(25)20-11-13-5-7-19-16(10-13)24-8-2-6-21-24/h2-10H,11H2,1H3,(H,20,25)(H,22,23)
InChIKeyNUXRFRLNRVSNNA-UHFFFAOYSA-N
XLogP2.38
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.37
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-methoxyphenyl)methyl]-5-methyl-1H-indazole-3-carboxamide
CID 78858952
4-(methylamino)-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]butanamide
CID 119846908
5-cyclopropyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-pyrazole-3-carboxamide
CID 46481157
1-[(2-methylphenyl)methyl]-3-[(2-pyrazol-1-yl-4-pyridinyl)methyl]urea
CID 35651512
4-(methylamino)-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]butanamide;dihydrochloride
CID 119846907
4-amino-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]pentanamide;dihydrochloride
CID 120564578
5-methyl-N-(thiophen-2-ylmethyl)-1H-indazole-3-carboxamide
CID 78859110
4-oxo-3-pentyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]phthalazine-1-carboxamide
CID 55619927
2-(5-methyl-2-propan-2-ylphenoxy)-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propanamide
CID 55852845
N-[2-(furan-2-carbonylamino)ethyl]-5-methyl-1H-indazole-3-carboxamide
CID 78869375
5-chloro-2-iodo-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]benzamide
CID 55690439
5-methyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-1H-indazole-3-carboxamide
CID 78859139

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide?
The IUPAC name of 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide (CID 78866292) is 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide is Cc1ccc2[nH]nc(C(=O)NCc3ccnc(-n4cccn4)c3)c2c1.
What is the InChIKey of 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide?
The InChIKey is NUXRFRLNRVSNNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N6O/c1-12-3-4-15-14(9-12)17(23-22-15)18(25)20-11-13-5-7-19-16(10-13)24-8-2-6-21-24/h2-10H,11H2,1H3,(H,20,25)(H,22,23).
What are the key properties of 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide?
5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide has a molecular weight of 332.37 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 78866292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).