5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine

C10H11N3S — CID 148997787

IUPAC5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine
SMILESCSCc1ccc(-n2cccn2)nc1
InChIInChI=1S/C10H11N3S/c1-14-8-9-3-4-10(11-7-9)13-6-2-5-12-13/h2-7H,8H2,1H3
InChIKeyPZAPVYRFNDZUEN-UHFFFAOYSA-N
MW205.29 g/mol
LogP2.13
Rot. Bonds3

About 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine

5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine (PubChem CID 148997787) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine.

Molecular Properties

Compound Name5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine
PubChem CID148997787
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC Name5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine
SMILESCSCc1ccc(-n2cccn2)nc1
InChIInChI=1S/C10H11N3S/c1-14-8-9-3-4-10(11-7-9)13-6-2-5-12-13/h2-7H,8H2,1H3
InChIKeyPZAPVYRFNDZUEN-UHFFFAOYSA-N
XLogP2.13
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(6-pyrazol-1-yl-3-pyridinyl)methyl]pyrimidin-2-amine
CID 25480347
(E)-N-[(6-pyrazol-1-yl-3-pyridinyl)methoxy]butan-2-imine
CID 59705404
1-phenyl-3-(6-pyrazol-1-yl-3-pyridinyl)propan-1-one
CID 91444784
N-[(4-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine
CID 43704289
(2S)-2-methyl-N-[(6-pyrazol-1-yl-3-pyridinyl)methyl]butanamide
CID 25349454
(2R)-2-methyl-N-[(6-pyrazol-1-yl-3-pyridinyl)methyl]butanamide
CID 25349453
(E)-N-[(6-chloro-3-pyridinyl)methoxy]butan-2-imine;(E)-N-[(6-pyrazol-1-yl-3-pyridinyl)methoxy]butan-2-imine
CID 172984452
N-(6-pyrazol-1-yl-3-pyridinyl)acetamide
CID 47153389
tert-butyl N-[(6-pyrazol-1-yl-3-pyridinyl)methyl]carbamate
CID 134193569
N-(pyrazolo[1,5-a]pyrimidin-6-ylmethyl)-1-(6-pyrazol-1-yl-3-pyridinyl)methanamine
CID 51104033
N-(1-phenylpropyl)-6-pyrazol-1-ylpyridin-3-amine
CID 43704473
1-(6-pyrazol-1-yl-3-pyridinyl)ethanamine
CID 115563158

Frequently Asked Questions

What is the IUPAC name of 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine?
The IUPAC name of 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine (CID 148997787) is 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine.
What is the SMILES notation for 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine?
The canonical SMILES for 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine is CSCc1ccc(-n2cccn2)nc1.
What is the InChIKey of 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine?
The InChIKey is PZAPVYRFNDZUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c1-14-8-9-3-4-10(11-7-9)13-6-2-5-12-13/h2-7H,8H2,1H3.
What are the key properties of 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine?
5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine has a molecular weight of 205.29 g/mol, XLogP of 2.13, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylsulfanylmethyl)-2-pyrazol-1-ylpyridine is sourced from PubChem (CID 148997787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).