6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine

C11H16N6S — CID 79239053

IUPAC6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CSc2nnnn2C)n1
InChIInChI=1S/C11H16N6S/c1-3-7-12-10-6-4-5-9(13-10)8-18-11-14-15-16-17(11)2/h4-6H,3,7-8H2,1-2H3,(H,12,13)
InChIKeyVIYPSLNRXYKUCO-UHFFFAOYSA-N
MW264.36 g/mol
LogP1.72
Rot. Bonds6

About 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine

6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine (PubChem CID 79239053) has the molecular formula C11H16N6S and a molecular weight of 264.36 g/mol. Its IUPAC name is 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine
PubChem CID79239053
Molecular FormulaC11H16N6S
Molecular Weight264.36 g/mol
Exact Mass264.12
IUPAC Name6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CSc2nnnn2C)n1
InChIInChI=1S/C11H16N6S/c1-3-7-12-10-6-4-5-9(13-10)8-18-11-14-15-16-17(11)2/h4-6H,3,7-8H2,1-2H3,(H,12,13)
InChIKeyVIYPSLNRXYKUCO-UHFFFAOYSA-N
XLogP1.72
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.36
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-methyl-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]pyridin-2-amine
CID 79239132
2-chloro-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]pyridine
CID 79037574
2-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-4-amine
CID 79259420
6-[(4-methoxyphenyl)sulfanylmethyl]-N-propylpyridin-2-amine
CID 79239390
3-[[6-(propylamino)-2-pyridinyl]methylsulfanyl]propane-1,2-diol
CID 79671978
6-[(2-methoxyphenyl)sulfanylmethyl]-N-propylpyridin-2-amine
CID 79238892
N-propyl-6-(pyrazol-1-ylmethyl)pyridin-2-amine
CID 79232077
N-[1-(2-methylphenyl)-2-(1-methyltetrazol-5-yl)sulfanylethyl]propan-1-amine
CID 64620409
4-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-phenyl-1,3-thiazol-2-amine
CID 2345699
N-[2-(1-methyltetrazol-5-yl)sulfanylethyl]aniline
CID 62578977
4-methyl-6-(1-methyltetrazol-5-yl)sulfanyl-N-propylpyrimidin-2-amine
CID 80887590
ethyl N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]carbamate
CID 135230223

Frequently Asked Questions

What is the IUPAC name of 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine?
The IUPAC name of 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine (CID 79239053) is 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine?
The canonical SMILES for 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine is CCCNc1cccc(CSc2nnnn2C)n1.
What is the InChIKey of 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine?
The InChIKey is VIYPSLNRXYKUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6S/c1-3-7-12-10-6-4-5-9(13-10)8-18-11-14-15-16-17(11)2/h4-6H,3,7-8H2,1-2H3,(H,12,13).
What are the key properties of 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine?
6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine has a molecular weight of 264.36 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 79239053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).