5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide

C16H13N5O2 — CID 146127327

IUPAC5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide
SMILESCn1ncc2c(NC(=O)c3cc(-c4ccco4)[nH]n3)cccc21
InChIInChI=1S/C16H13N5O2/c1-21-14-5-2-4-11(10(14)9-17-21)18-16(22)13-8-12(19-20-13)15-6-3-7-23-15/h2-9H,1H3,(H,18,22)(H,19,20)
InChIKeyMFJIFTDLSOVBBX-UHFFFAOYSA-N
MW307.31 g/mol
LogP2.81
Rot. Bonds3

About 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide

5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide (PubChem CID 146127327) has the molecular formula C16H13N5O2 and a molecular weight of 307.31 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide
PubChem CID146127327
Molecular FormulaC16H13N5O2
Molecular Weight307.31 g/mol
Exact Mass307.11
IUPAC Name5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide
SMILESCn1ncc2c(NC(=O)c3cc(-c4ccco4)[nH]n3)cccc21
InChIInChI=1S/C16H13N5O2/c1-21-14-5-2-4-11(10(14)9-17-21)18-16(22)13-8-12(19-20-13)15-6-3-7-23-15/h2-9H,1H3,(H,18,22)(H,19,20)
InChIKeyMFJIFTDLSOVBBX-UHFFFAOYSA-N
XLogP2.81
TPSA88.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.31
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide (CID 146127327) is 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide is Cn1ncc2c(NC(=O)c3cc(-c4ccco4)[nH]n3)cccc21.
What is the InChIKey of 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide?
The InChIKey is MFJIFTDLSOVBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N5O2/c1-21-14-5-2-4-11(10(14)9-17-21)18-16(22)13-8-12(19-20-13)15-6-3-7-23-15/h2-9H,1H3,(H,18,22)(H,19,20).
What are the key properties of 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide?
5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide has a molecular weight of 307.31 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 146127327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).