N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide

C14H12N6O2 — CID 46880374

IUPACN-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(C2N=NN=N2)c(-c2ccco2)n1)C1CC1
InChIInChI=1S/C14H12N6O2/c21-14(8-3-4-8)16-11-6-5-9(13-17-19-20-18-13)12(15-11)10-2-1-7-22-10/h1-2,5-8,13H,3-4H2,(H,15,16,21)
InChIKeyMMRPFVNUEBTETA-UHFFFAOYSA-N
MW296.29 g/mol
LogP3.52
Rot. Bonds4

About N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide

N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 46880374) has the molecular formula C14H12N6O2 and a molecular weight of 296.29 g/mol. Its IUPAC name is N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide
PubChem CID46880374
Molecular FormulaC14H12N6O2
Molecular Weight296.29 g/mol
Exact Mass296.10
IUPAC NameN-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(C2N=NN=N2)c(-c2ccco2)n1)C1CC1
InChIInChI=1S/C14H12N6O2/c21-14(8-3-4-8)16-11-6-5-9(13-17-19-20-18-13)12(15-11)10-2-1-7-22-10/h1-2,5-8,13H,3-4H2,(H,15,16,21)
InChIKeyMMRPFVNUEBTETA-UHFFFAOYSA-N
XLogP3.52
TPSA104.57 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.29
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide (CID 46880374) is N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide is O=C(Nc1ccc(C2N=NN=N2)c(-c2ccco2)n1)C1CC1.
What is the InChIKey of N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is MMRPFVNUEBTETA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N6O2/c21-14(8-3-4-8)16-11-6-5-9(13-17-19-20-18-13)12(15-11)10-2-1-7-22-10/h1-2,5-8,13H,3-4H2,(H,15,16,21).
What are the key properties of N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide?
N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 296.29 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(furan-2-yl)-5-(5H-tetrazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 46880374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).