4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide

C9H10N6O — CID 13209554

IUPAC4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESCCc1ccnc(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C9H10N6O/c1-2-6-3-4-10-7(5-6)8(16)11-9-12-14-15-13-9/h3-5H,2H2,1H3,(H2,11,12,13,14,15,16)
InChIKeyPNUVSKAJPOBZJL-UHFFFAOYSA-N
MW218.22 g/mol
LogP0.41
Rot. Bonds3

About 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide

4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide (PubChem CID 13209554) has the molecular formula C9H10N6O and a molecular weight of 218.22 g/mol. Its IUPAC name is 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
PubChem CID13209554
Molecular FormulaC9H10N6O
Molecular Weight218.22 g/mol
Exact Mass218.09
IUPAC Name4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESCCc1ccnc(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C9H10N6O/c1-2-6-3-4-10-7(5-6)8(16)11-9-12-14-15-13-9/h3-5H,2H2,1H3,(H2,11,12,13,14,15,16)
InChIKeyPNUVSKAJPOBZJL-UHFFFAOYSA-N
XLogP0.41
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The IUPAC name of 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide (CID 13209554) is 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide is CCc1ccnc(C(=O)Nc2nn[nH]n2)c1.
What is the InChIKey of 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The InChIKey is PNUVSKAJPOBZJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6O/c1-2-6-3-4-10-7(5-6)8(16)11-9-12-14-15-13-9/h3-5H,2H2,1H3,(H2,11,12,13,14,15,16).
What are the key properties of 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide has a molecular weight of 218.22 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide is sourced from PubChem (CID 13209554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).