7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide

C19H17N5O3 — CID 70353187

IUPAC7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide
SMILESCC(C)Oc1oc(C(=O)Nc2nn[nH]n2)c2c(-c3ccccc3)cccc12
InChIInChI=1S/C19H17N5O3/c1-11(2)26-18-14-10-6-9-13(12-7-4-3-5-8-12)15(14)16(27-18)17(25)20-19-21-23-24-22-19/h3-11H,1-2H3,(H2,20,21,22,23,24,25)
InChIKeyATWBNGUXEQTFKX-UHFFFAOYSA-N
MW363.38 g/mol
LogP3.65
Rot. Bonds5

About 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide

7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide (PubChem CID 70353187) has the molecular formula C19H17N5O3 and a molecular weight of 363.38 g/mol. Its IUPAC name is 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide.

Molecular Properties

Compound Name7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide
PubChem CID70353187
Molecular FormulaC19H17N5O3
Molecular Weight363.38 g/mol
Exact Mass363.13
IUPAC Name7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide
SMILESCC(C)Oc1oc(C(=O)Nc2nn[nH]n2)c2c(-c3ccccc3)cccc12
InChIInChI=1S/C19H17N5O3/c1-11(2)26-18-14-10-6-9-13(12-7-4-3-5-8-12)15(14)16(27-18)17(25)20-19-21-23-24-22-19/h3-11H,1-2H3,(H2,20,21,22,23,24,25)
InChIKeyATWBNGUXEQTFKX-UHFFFAOYSA-N
XLogP3.65
TPSA105.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.38
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide 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

CID 2473871
CID 2473871
CID 11225866
CID 11225866
CID 13961697
CID 13961697
CID 13961699
CID 13961699
CID 13961701
CID 13961701
CID 13961742
CID 13961742
CID 21045743
CID 21045743
CID 68113279
CID 68113279
CID 70352926
CID 70352926
CID 70353125
CID 70353125
CID 70353188
CID 70353188
CID 70353374
CID 70353374

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide?
The IUPAC name of 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide (CID 70353187) is 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide.
What is the SMILES notation for 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide?
The canonical SMILES for 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide is CC(C)Oc1oc(C(=O)Nc2nn[nH]n2)c2c(-c3ccccc3)cccc12.
What is the InChIKey of 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide?
The InChIKey is ATWBNGUXEQTFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O3/c1-11(2)26-18-14-10-6-9-13(12-7-4-3-5-8-12)15(14)16(27-18)17(25)20-19-21-23-24-22-19/h3-11H,1-2H3,(H2,20,21,22,23,24,25).
What are the key properties of 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide?
7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide has a molecular weight of 363.38 g/mol, XLogP of 3.65, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide is sourced from PubChem (CID 70353187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).