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

C17H14N4O2 — CID 71704027

IUPAC5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide
SMILESCn1ccc2c(NC(=O)c3cc(-c4ccco4)[nH]n3)cccc21
InChIInChI=1S/C17H14N4O2/c1-21-8-7-11-12(4-2-5-15(11)21)18-17(22)14-10-13(19-20-14)16-6-3-9-23-16/h2-10H,1H3,(H,18,22)(H,19,20)
InChIKeyBAYHBEXJINTNLX-UHFFFAOYSA-N
MW306.33 g/mol
LogP3.41
Rot. Bonds3

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

5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide (PubChem CID 71704027) has the molecular formula C17H14N4O2 and a molecular weight of 306.33 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide
PubChem CID71704027
Molecular FormulaC17H14N4O2
Molecular Weight306.33 g/mol
Exact Mass306.11
IUPAC Name5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide
SMILESCn1ccc2c(NC(=O)c3cc(-c4ccco4)[nH]n3)cccc21
InChIInChI=1S/C17H14N4O2/c1-21-8-7-11-12(4-2-5-15(11)21)18-17(22)14-10-13(19-20-14)16-6-3-9-23-16/h2-10H,1H3,(H,18,22)(H,19,20)
InChIKeyBAYHBEXJINTNLX-UHFFFAOYSA-N
XLogP3.41
TPSA75.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.33
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(furan-2-yl)-N-(1-methylindazol-4-yl)-1H-pyrazole-3-carboxamide
CID 146127327
5-(furan-2-yl)-N-[2-(propan-2-ylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide
CID 34564904
5-(furan-2-yl)-N-(3-methylphenyl)-1H-pyrazole-3-carboxamide
CID 47156334
5-(furan-2-yl)-N-(3-methoxyphenyl)-1H-pyrazole-3-carboxamide
CID 19513850
N-tert-butyl-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 6626158
N-(5-carbamoyl-3-fluoro-2-methylphenyl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 87045713
N-(5-chloro-1-methylbenzimidazol-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 86868766
5-(furan-2-yl)-N-(2-hydroxy-4-nitrophenyl)-1H-pyrazole-3-carboxamide
CID 19514103
5-(furan-2-yl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)-1H-pyrazole-3-carboxamide
CID 90538388
N-[(1-ethylpyrazol-4-yl)methyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 19513881
N-[2-(difluoromethoxy)-4-methylphenyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 19513943
5-(furan-2-yl)-N-prop-2-ynyl-1H-pyrazole-3-carboxamide
CID 25353049

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide (CID 71704027) is 5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide is Cn1ccc2c(NC(=O)c3cc(-c4ccco4)[nH]n3)cccc21.
What is the InChIKey of 5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide?
The InChIKey is BAYHBEXJINTNLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2/c1-21-8-7-11-12(4-2-5-15(11)21)18-17(22)14-10-13(19-20-14)16-6-3-9-23-16/h2-10H,1H3,(H,18,22)(H,19,20).
What are the key properties of 5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide?
5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide has a molecular weight of 306.33 g/mol, XLogP of 3.41, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-N-(1-methylindol-4-yl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 71704027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).