2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine

C10H11N9 — CID 102517127

IUPAC2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine
SMILESc1ccc(-c2nnnn2CCCn2cnnn2)nc1
InChIInChI=1S/C10H11N9/c1-2-5-11-9(4-1)10-13-15-17-19(10)7-3-6-18-8-12-14-16-18/h1-2,4-5,8H,3,6-7H2
InChIKeyGREBEYCCJWAVGF-UHFFFAOYSA-N
MW257.26 g/mol
LogP-0.19
Rot. Bonds5

About 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine

2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine (PubChem CID 102517127) has the molecular formula C10H11N9 and a molecular weight of 257.26 g/mol. Its IUPAC name is 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine.

Molecular Properties

Compound Name2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine
PubChem CID102517127
Molecular FormulaC10H11N9
Molecular Weight257.26 g/mol
Exact Mass257.11
IUPAC Name2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine
SMILESc1ccc(-c2nnnn2CCCn2cnnn2)nc1
InChIInChI=1S/C10H11N9/c1-2-5-11-9(4-1)10-13-15-17-19(10)7-3-6-18-8-12-14-16-18/h1-2,4-5,8H,3,6-7H2
InChIKeyGREBEYCCJWAVGF-UHFFFAOYSA-N
XLogP-0.19
TPSA100.09 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.26
LogP ≤ 5-0.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Related Compounds

2-[3-(5-pyridin-2-yltetrazol-1-yl)propyl]isoindole-1,3-dione
CID 53483400
2-(1-benzyltetrazol-5-yl)pyridine
CID 86063303
2-(4-propyl-1,2,4-triazol-3-yl)pyridine
CID 115394967
(2R)-1-(2-methylphenoxy)-3-(5-pyridin-2-yltetrazol-1-yl)propan-2-ol
CID 95776103
3-pyridin-2-yl-5-(tetrazol-1-ylmethyl)-1,2,4-oxadiazole
CID 75370384
4-[5-(4-methyl-2-pyridinyl)tetrazol-1-yl]butan-1-amine
CID 114182237
4,4-dimethyl-2-[(5-pyridin-2-yltetrazol-1-yl)methyl]pentanoic acid
CID 107475047
N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-4-(tetrazol-1-yl)butanamide
CID 118796031
2-[1-(4-ethoxyphenyl)tetrazol-5-yl]pyridine
CID 2140206
2-[1-[[(2R)-1-oxaspiro[4.5]decan-2-yl]methyl]tetrazol-5-yl]pyridine
CID 129486887
4-[(5-pyridin-2-yltetrazol-1-yl)methyl]-1,2,5-oxadiazole-3-carboximidamide
CID 140518111
4-[5-(1-methylpyrazol-3-yl)tetrazol-1-yl]butan-1-amine
CID 106387289

Frequently Asked Questions

What is the IUPAC name of 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine?
The IUPAC name of 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine (CID 102517127) is 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine.
What is the SMILES notation for 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine?
The canonical SMILES for 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine is c1ccc(-c2nnnn2CCCn2cnnn2)nc1.
What is the InChIKey of 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine?
The InChIKey is GREBEYCCJWAVGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N9/c1-2-5-11-9(4-1)10-13-15-17-19(10)7-3-6-18-8-12-14-16-18/h1-2,4-5,8H,3,6-7H2.
What are the key properties of 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine?
2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine has a molecular weight of 257.26 g/mol, XLogP of -0.19, 5 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[3-(tetrazol-1-yl)propyl]tetrazol-5-yl]pyridine is sourced from PubChem (CID 102517127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).