N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide

C13H11N5O3 — CID 4155435

IUPACN-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide
SMILESCOc1cc(NC(=O)c2ccco2)cc(-n2cnnn2)c1
InChIInChI=1S/C13H11N5O3/c1-20-11-6-9(15-13(19)12-3-2-4-21-12)5-10(7-11)18-8-14-16-17-18/h2-8H,1H3,(H,15,19)
InChIKeyLAUVUCCLBJVMAI-UHFFFAOYSA-N
MW285.26 g/mol
LogP1.52
Rot. Bonds4

About N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide

N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide (PubChem CID 4155435) has the molecular formula C13H11N5O3 and a molecular weight of 285.26 g/mol. Its IUPAC name is N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide
PubChem CID4155435
Molecular FormulaC13H11N5O3
Molecular Weight285.26 g/mol
Exact Mass285.09
IUPAC NameN-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide
SMILESCOc1cc(NC(=O)c2ccco2)cc(-n2cnnn2)c1
InChIInChI=1S/C13H11N5O3/c1-20-11-6-9(15-13(19)12-3-2-4-21-12)5-10(7-11)18-8-14-16-17-18/h2-8H,1H3,(H,15,19)
InChIKeyLAUVUCCLBJVMAI-UHFFFAOYSA-N
XLogP1.52
TPSA95.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.26
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(2-aminoethyl)-N-[3-methoxy-5-(tetrazol-1-yl)phenyl]benzamide;hydrochloride
CID 154912324
N-[3-methyl-4-(tetrazol-1-yl)phenyl]furan-2-carboxamide
CID 858850
N-[4-[[2-[4-(tetrazol-1-yl)phenyl]acetyl]amino]phenyl]furan-2-carboxamide
CID 30896780
2-cyclopropyl-N-[3-methoxy-5-(tetrazol-1-yl)phenyl]pyrimidine-5-carboxamide
CID 131896599
N-[4-[(3,5-dimethoxyphenyl)carbamothioylamino]phenyl]furan-2-carboxamide
CID 57305477
N-[3-oxo-3-[3-(tetrazol-1-yl)anilino]propyl]furan-2-carboxamide
CID 29452089
1-ethyl-N-[3-methoxy-5-(tetrazol-1-yl)phenyl]-3-(2-methylpropyl)pyrazole-5-carboxamide
CID 131924947
2-(dimethylamino)-N-[3-methoxy-5-(tetrazol-1-yl)phenyl]-4-methylpyrimidine-5-carboxamide
CID 131935094
3-cyclopentyl-N-[3-methoxy-5-(tetrazol-1-yl)phenyl]propanamide
CID 1231769
N-[4-[(3-methoxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 780805
dimethyl 5-(furan-2-carbonylamino)benzene-1,3-dicarboxylate
CID 711226
5-[[3-methoxy-5-(tetrazol-1-yl)anilino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 168537750

Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide (CID 4155435) is N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide is COc1cc(NC(=O)c2ccco2)cc(-n2cnnn2)c1.
What is the InChIKey of N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide?
The InChIKey is LAUVUCCLBJVMAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5O3/c1-20-11-6-9(15-13(19)12-3-2-4-21-12)5-10(7-11)18-8-14-16-17-18/h2-8H,1H3,(H,15,19).
What are the key properties of N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide?
N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide has a molecular weight of 285.26 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-5-(tetrazol-1-yl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 4155435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).