6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine

C20H23N5S — CID 144988036

IUPAC6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine
SMILESCc1cc(SC2CCNCC2)cc(Nc2cc(-c3ccccc3)[nH]n2)n1
InChIInChI=1S/C20H23N5S/c1-14-11-17(26-16-7-9-21-10-8-16)12-19(22-14)23-20-13-18(24-25-20)15-5-3-2-4-6-15/h2-6,11-13,16,21H,7-10H2,1H3,(H2,22,23,24,25)
InChIKeyLLHIXXQQRMYGEN-UHFFFAOYSA-N
MW365.51 g/mol
LogP4.37
Rot. Bonds5

About 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine

6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine (PubChem CID 144988036) has the molecular formula C20H23N5S and a molecular weight of 365.51 g/mol. Its IUPAC name is 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine.

Molecular Properties

Compound Name6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine
PubChem CID144988036
Molecular FormulaC20H23N5S
Molecular Weight365.51 g/mol
Exact Mass365.17
IUPAC Name6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine
SMILESCc1cc(SC2CCNCC2)cc(Nc2cc(-c3ccccc3)[nH]n2)n1
InChIInChI=1S/C20H23N5S/c1-14-11-17(26-16-7-9-21-10-8-16)12-19(22-14)23-20-13-18(24-25-20)15-5-3-2-4-6-15/h2-6,11-13,16,21H,7-10H2,1H3,(H2,22,23,24,25)
InChIKeyLLHIXXQQRMYGEN-UHFFFAOYSA-N
XLogP4.37
TPSA65.63 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.51
LogP ≤ 54.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine with MolForge

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Related Compounds

N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-6-methyl-4-phenylsulfanylpyridin-2-amine
CID 144988150
6-methyl-2-phenyl-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine
CID 10131417
2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine
CID 139220875
6-methyl-2-[(4-methylphenoxy)methyl]-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine
CID 70949618
6-chloro-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-1-ylsulfanylpyridin-2-amine
CID 144988121
4-[[6-[[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]amino]-4-phenylsulfanyl-2-pyridinyl]amino]cyclohexan-1-ol
CID 144988185
2-methyl-5-piperidin-4-ylsulfanylpyridine
CID 166120275
2,4-dimethyl-6-piperidin-4-ylsulfanylpyridine
CID 102925601
(5-phenyl-1H-pyrazol-3-yl)hydrazine
CID 13016518
6-methoxy-N-(5-phenyl-1H-pyrazol-3-yl)-7-(1-piperidin-4-ylethoxy)quinazolin-4-amine
CID 70214730
6-methyl-N-(5-methyl-1H-pyrazol-3-yl)-2-(phenylsulfanylmethyl)pyrimidin-4-amine
CID 20604303
5-naphthalen-2-yl-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114697920

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine?
The IUPAC name of 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine (CID 144988036) is 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine.
What is the SMILES notation for 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine?
The canonical SMILES for 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine is Cc1cc(SC2CCNCC2)cc(Nc2cc(-c3ccccc3)[nH]n2)n1.
What is the InChIKey of 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine?
The InChIKey is LLHIXXQQRMYGEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5S/c1-14-11-17(26-16-7-9-21-10-8-16)12-19(22-14)23-20-13-18(24-25-20)15-5-3-2-4-6-15/h2-6,11-13,16,21H,7-10H2,1H3,(H2,22,23,24,25).
What are the key properties of 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine?
6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine has a molecular weight of 365.51 g/mol, XLogP of 4.37, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine is sourced from PubChem (CID 144988036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).