5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile

C14H10N4O2 — CID 82199008

IUPAC5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile
SMILESCOc1ccccc1-n1nnc(C#N)c1-c1ccco1
InChIInChI=1S/C14H10N4O2/c1-19-12-6-3-2-5-11(12)18-14(10(9-15)16-17-18)13-7-4-8-20-13/h2-8H,1H3
InChIKeyOGBHMOMTEZFDHC-UHFFFAOYSA-N
MW266.26 g/mol
LogP2.41
Rot. Bonds3

About 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile

5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile (PubChem CID 82199008) has the molecular formula C14H10N4O2 and a molecular weight of 266.26 g/mol. Its IUPAC name is 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile.

Molecular Properties

Compound Name5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile
PubChem CID82199008
Molecular FormulaC14H10N4O2
Molecular Weight266.26 g/mol
Exact Mass266.08
IUPAC Name5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile
SMILESCOc1ccccc1-n1nnc(C#N)c1-c1ccco1
InChIInChI=1S/C14H10N4O2/c1-19-12-6-3-2-5-11(12)18-14(10(9-15)16-17-18)13-7-4-8-20-13/h2-8H,1H3
InChIKeyOGBHMOMTEZFDHC-UHFFFAOYSA-N
XLogP2.41
TPSA76.87 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-methoxyphenyl)-5-pyridin-3-yltriazole-4-carbonitrile
CID 82199035
5-(furan-2-yl)-1-(3-methylphenyl)triazole-4-carbonitrile
CID 82197960
3-(2-methoxyphenyl)furo[3,4-d]triazole-4,6-dione
CID 82369551
1-(3-chloro-4-fluorophenyl)-5-(furan-2-yl)triazole-4-carbonitrile
CID 82195388
N-[3-[4-cyano-5-(furan-2-yl)triazol-1-yl]phenyl]acetamide
CID 82199343
[1-(2,4-dimethoxyphenyl)-5-(furan-2-yl)triazol-4-yl]methanamine
CID 82197918
5-(furan-2-yl)-1-(4-phenoxybutyl)triazole-4-carbonitrile
CID 94945251
1-(2-methoxyphenyl)benzotriazole
CID 53415460
1-(4-chloro-3-nitrophenyl)-5-(furan-2-yl)triazole-4-carbonitrile
CID 94938070
4-[[5-(furan-2-yl)-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile
CID 42793903
1-(5-chloro-2-methoxyphenyl)-5-thiophen-2-yltriazole-4-carbonitrile
CID 94938759
1-(2-ethoxyphenyl)-5-[(E)-2-phenylethenyl]triazole-4-carbonitrile
CID 94937901

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile?
The IUPAC name of 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile (CID 82199008) is 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile.
What is the SMILES notation for 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile?
The canonical SMILES for 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile is COc1ccccc1-n1nnc(C#N)c1-c1ccco1.
What is the InChIKey of 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile?
The InChIKey is OGBHMOMTEZFDHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O2/c1-19-12-6-3-2-5-11(12)18-14(10(9-15)16-17-18)13-7-4-8-20-13/h2-8H,1H3.
What are the key properties of 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile?
5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile has a molecular weight of 266.26 g/mol, XLogP of 2.41, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-1-(2-methoxyphenyl)triazole-4-carbonitrile is sourced from PubChem (CID 82199008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).