N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide

C10H8N4O2 — CID 78913763

IUPACN-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)Nc2[nH]ncc2C#N)o1
InChIInChI=1S/C10H8N4O2/c1-6-2-3-8(16-6)10(15)13-9-7(4-11)5-12-14-9/h2-3,5H,1H3,(H2,12,13,14,15)
InChIKeyKXEVDWJLKTVRDL-UHFFFAOYSA-N
MW216.20 g/mol
LogP1.44
Rot. Bonds2

About N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide

N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide (PubChem CID 78913763) has the molecular formula C10H8N4O2 and a molecular weight of 216.20 g/mol. Its IUPAC name is N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide
PubChem CID78913763
Molecular FormulaC10H8N4O2
Molecular Weight216.20 g/mol
Exact Mass216.06
IUPAC NameN-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)Nc2[nH]ncc2C#N)o1
InChIInChI=1S/C10H8N4O2/c1-6-2-3-8(16-6)10(15)13-9-7(4-11)5-12-14-9/h2-3,5H,1H3,(H2,12,13,14,15)
InChIKeyKXEVDWJLKTVRDL-UHFFFAOYSA-N
XLogP1.44
TPSA94.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide?
The IUPAC name of N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide (CID 78913763) is N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide.
What is the SMILES notation for N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide?
The canonical SMILES for N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide is Cc1ccc(C(=O)Nc2[nH]ncc2C#N)o1.
What is the InChIKey of N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide?
The InChIKey is KXEVDWJLKTVRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O2/c1-6-2-3-8(16-6)10(15)13-9-7(4-11)5-12-14-9/h2-3,5H,1H3,(H2,12,13,14,15).
What are the key properties of N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide?
N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide has a molecular weight of 216.20 g/mol, XLogP of 1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-1H-pyrazol-5-yl)-5-methylfuran-2-carboxamide is sourced from PubChem (CID 78913763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).