N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide

C18H15N5O2 — CID 166230691

IUPACN-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide
SMILESCc1c(C#N)nn(-c2cccnc2)c1NC(=O)c1ccoc1C1CC1
InChIInChI=1S/C18H15N5O2/c1-11-15(9-19)22-23(13-3-2-7-20-10-13)17(11)21-18(24)14-6-8-25-16(14)12-4-5-12/h2-3,6-8,10,12H,4-5H2,1H3,(H,21,24)
InChIKeyFPCQLLKSGSPZOL-UHFFFAOYSA-N
MW333.35 g/mol
LogP3.17
Rot. Bonds4

About N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide

N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide (PubChem CID 166230691) has the molecular formula C18H15N5O2 and a molecular weight of 333.35 g/mol. Its IUPAC name is N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide
PubChem CID166230691
Molecular FormulaC18H15N5O2
Molecular Weight333.35 g/mol
Exact Mass333.12
IUPAC NameN-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide
SMILESCc1c(C#N)nn(-c2cccnc2)c1NC(=O)c1ccoc1C1CC1
InChIInChI=1S/C18H15N5O2/c1-11-15(9-19)22-23(13-3-2-7-20-10-13)17(11)21-18(24)14-6-8-25-16(14)12-4-5-12/h2-3,6-8,10,12H,4-5H2,1H3,(H,21,24)
InChIKeyFPCQLLKSGSPZOL-UHFFFAOYSA-N
XLogP3.17
TPSA96.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.35
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide?
The IUPAC name of N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide (CID 166230691) is N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide.
What is the SMILES notation for N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide?
The canonical SMILES for N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide is Cc1c(C#N)nn(-c2cccnc2)c1NC(=O)c1ccoc1C1CC1.
What is the InChIKey of N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide?
The InChIKey is FPCQLLKSGSPZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O2/c1-11-15(9-19)22-23(13-3-2-7-20-10-13)17(11)21-18(24)14-6-8-25-16(14)12-4-5-12/h2-3,6-8,10,12H,4-5H2,1H3,(H,21,24).
What are the key properties of N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide?
N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide has a molecular weight of 333.35 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyano-4-methyl-2-pyridin-3-ylpyrazol-3-yl)-2-cyclopropylfuran-3-carboxamide is sourced from PubChem (CID 166230691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).