5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine

C9H15N5 — CID 10058439

IUPAC5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine
SMILESCCn1nnnc1C1=CCCN(C)C1
InChIInChI=1S/C9H15N5/c1-3-14-9(10-11-12-14)8-5-4-6-13(2)7-8/h5H,3-4,6-7H2,1-2H3
InChIKeyNOUIQGVNDUDKEB-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.41
Rot. Bonds2

About 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine

5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine (PubChem CID 10058439) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine
PubChem CID10058439
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine
SMILESCCn1nnnc1C1=CCCN(C)C1
InChIInChI=1S/C9H15N5/c1-3-14-9(10-11-12-14)8-5-4-6-13(2)7-8/h5H,3-4,6-7H2,1-2H3
InChIKeyNOUIQGVNDUDKEB-UHFFFAOYSA-N
XLogP0.41
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,3-thiazole
CID 19018552
1-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)benzimidazole
CID 11117783
3-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,4-oxadiazole
CID 142672393
2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-3-pentylsulfanylpyrazine;hydrochloride
CID 19800174
2-hexylsulfanyl-3-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)pyrazine;hydrochloride
CID 19800167
3-(2-fluoroethylsulfanyl)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole
CID 10061124
N-ethyl-3-methyl-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2-oxazol-5-amine;oxalic acid
CID 19603590
sodium 1-ethyltetrazole-5-thiolate
CID 102196687
1-ethylsulfanyl-3-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-phenyl-1,2,5-thiadiazol-1-ium
CID 172711663
ethyl 4-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]butanoate
CID 19075484
3-ethoxy-4-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]-1,2,5-thiadiazole
CID 19075416
4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-N-pentyl-1,2-oxazol-5-amine
CID 19603620

Frequently Asked Questions

What is the IUPAC name of 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The IUPAC name of 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine (CID 10058439) is 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine is CCn1nnnc1C1=CCCN(C)C1.
What is the InChIKey of 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The InChIKey is NOUIQGVNDUDKEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5/c1-3-14-9(10-11-12-14)8-5-4-6-13(2)7-8/h5H,3-4,6-7H2,1-2H3.
What are the key properties of 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine?
5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine has a molecular weight of 193.25 g/mol, XLogP of 0.41, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 10058439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).