N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide

C14H15N5O2 — CID 90653226

IUPACN-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide
SMILESCOCc1cc(CNC(=O)c2n[nH]c3ccccc23)[nH]n1
InChIInChI=1S/C14H15N5O2/c1-21-8-10-6-9(16-17-10)7-15-14(20)13-11-4-2-3-5-12(11)18-19-13/h2-6H,7-8H2,1H3,(H,15,20)(H,16,17)(H,18,19)
InChIKeyOLDOEAFNSCBIAW-UHFFFAOYSA-N
MW285.31 g/mol
LogP1.36
Rot. Bonds5

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

N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide (PubChem CID 90653226) has the molecular formula C14H15N5O2 and a molecular weight of 285.31 g/mol. Its IUPAC name is N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide
PubChem CID90653226
Molecular FormulaC14H15N5O2
Molecular Weight285.31 g/mol
Exact Mass285.12
IUPAC NameN-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide
SMILESCOCc1cc(CNC(=O)c2n[nH]c3ccccc23)[nH]n1
InChIInChI=1S/C14H15N5O2/c1-21-8-10-6-9(16-17-10)7-15-14(20)13-11-4-2-3-5-12(11)18-19-13/h2-6H,7-8H2,1H3,(H,15,20)(H,16,17)(H,18,19)
InChIKeyOLDOEAFNSCBIAW-UHFFFAOYSA-N
XLogP1.36
TPSA95.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 51.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide (CID 90653226) is N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide is COCc1cc(CNC(=O)c2n[nH]c3ccccc23)[nH]n1.
What is the InChIKey of N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide?
The InChIKey is OLDOEAFNSCBIAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2/c1-21-8-10-6-9(16-17-10)7-15-14(20)13-11-4-2-3-5-12(11)18-19-13/h2-6H,7-8H2,1H3,(H,15,20)(H,16,17)(H,18,19).
What are the key properties of N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide?
N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide has a molecular weight of 285.31 g/mol, XLogP of 1.36, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 90653226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).