3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide

C13H16N6O2 — CID 64893334

IUPAC3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide
SMILESCc1ccc(-n2cnnn2)cc1NC(=O)C1(N)CCOC1
InChIInChI=1S/C13H16N6O2/c1-9-2-3-10(19-8-15-17-18-19)6-11(9)16-12(20)13(14)4-5-21-7-13/h2-3,6,8H,4-5,7,14H2,1H3,(H,16,20)
InChIKeyFAPMUBDEXJNUJV-UHFFFAOYSA-N
MW288.31 g/mol
LogP0.03
Rot. Bonds3

About 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide

3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide (PubChem CID 64893334) has the molecular formula C13H16N6O2 and a molecular weight of 288.31 g/mol. Its IUPAC name is 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide
PubChem CID64893334
Molecular FormulaC13H16N6O2
Molecular Weight288.31 g/mol
Exact Mass288.13
IUPAC Name3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide
SMILESCc1ccc(-n2cnnn2)cc1NC(=O)C1(N)CCOC1
InChIInChI=1S/C13H16N6O2/c1-9-2-3-10(19-8-15-17-18-19)6-11(9)16-12(20)13(14)4-5-21-7-13/h2-3,6,8H,4-5,7,14H2,1H3,(H,16,20)
InChIKeyFAPMUBDEXJNUJV-UHFFFAOYSA-N
XLogP0.03
TPSA107.95 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-amino-N-[4-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide
CID 64892992
(1R)-2,2-dichloro-1-methyl-N-[2-methyl-5-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide
CID 94001278
N-(5-acetamido-2-methylphenyl)-3-aminooxolane-3-carboxamide
CID 64893119
3-amino-N-[5-(ethylcarbamoyl)-2-methylphenyl]oxolane-3-carboxamide
CID 64891539
N-[2-methyl-5-(tetrazol-1-yl)phenyl]benzamide
CID 60789520
N-[2-methyl-5-(tetrazol-1-yl)phenyl]cyclopentanecarboxamide
CID 47047444
3-amino-4-[2-methyl-5-(tetrazol-1-yl)anilino]-4-oxobutanoic acid
CID 64895694
4-N-tert-butyl-1-N-[2-methyl-5-(tetrazol-1-yl)phenyl]benzene-1,4-dicarboxamide
CID 48857945
3-amino-N-(3,4-dimethylphenyl)oxolane-3-carboxamide
CID 64891886
2-[[2-methyl-5-(tetrazol-1-yl)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 60940554
2-(tert-butylamino)-N-[2-methyl-5-(tetrazol-1-yl)phenyl]acetamide
CID 78923820
5-hydroxy-N-[2-methyl-5-(tetrazol-1-yl)phenyl]pentanamide
CID 79198857

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide (CID 64893334) is 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide is Cc1ccc(-n2cnnn2)cc1NC(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide?
The InChIKey is FAPMUBDEXJNUJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N6O2/c1-9-2-3-10(19-8-15-17-18-19)6-11(9)16-12(20)13(14)4-5-21-7-13/h2-3,6,8H,4-5,7,14H2,1H3,(H,16,20).
What are the key properties of 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide?
3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide has a molecular weight of 288.31 g/mol, XLogP of 0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-methyl-5-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide is sourced from PubChem (CID 64893334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).