N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide

C17H14N4O2 — CID 97447225

IUPACN-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccnn1-c1ccc2ccccn12
InChIInChI=1S/C17H14N4O2/c22-17(18-12-14-5-3-11-23-14)15-8-9-19-21(15)16-7-6-13-4-1-2-10-20(13)16/h1-11H,12H2,(H,18,22)
InChIKeyWXOSVYZPJQDIIZ-UHFFFAOYSA-N
MW306.33 g/mol
LogP2.65
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide

N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide (PubChem CID 97447225) has the molecular formula C17H14N4O2 and a molecular weight of 306.33 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide
PubChem CID97447225
Molecular FormulaC17H14N4O2
Molecular Weight306.33 g/mol
Exact Mass306.11
IUPAC NameN-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccnn1-c1ccc2ccccn12
InChIInChI=1S/C17H14N4O2/c22-17(18-12-14-5-3-11-23-14)15-8-9-19-21(15)16-7-6-13-4-1-2-10-20(13)16/h1-11H,12H2,(H,18,22)
InChIKeyWXOSVYZPJQDIIZ-UHFFFAOYSA-N
XLogP2.65
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-(furan-2-ylmethylcarbamoyl)pyrazol-1-yl]acetic acid
CID 19482452
3-[5-(furan-2-ylmethylcarbamoyl)pyrazol-1-yl]propanoic acid
CID 19490099
3-ethyl-N-(furan-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 110674625
N-(furan-2-ylmethyl)-6,10-dimethyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
CID 852295
N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1252016
1-N-(furan-2-ylmethyl)-3-N-(2-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070124
N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide
CID 9034607
1-(furan-2-ylmethyl)-3-(3-pyrazol-1-ylpropyl)urea
CID 47176690
3-N-(furan-2-ylmethyl)-1-N-phenylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070188
(6R)-N-(furan-2-ylmethyl)-6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
CID 93009686
N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide
CID 61462816
N-(furan-2-ylmethyl)-N'-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]oxamide
CID 122266212

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide (CID 97447225) is N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide is O=C(NCc1ccco1)c1ccnn1-c1ccc2ccccn12.
What is the InChIKey of N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide?
The InChIKey is WXOSVYZPJQDIIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2/c22-17(18-12-14-5-3-11-23-14)15-8-9-19-21(15)16-7-6-13-4-1-2-10-20(13)16/h1-11H,12H2,(H,18,22).
What are the key properties of N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide?
N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide has a molecular weight of 306.33 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-indolizin-3-ylpyrazole-3-carboxamide is sourced from PubChem (CID 97447225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).