N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine

C18H25N5O2S — CID 95823846

IUPACN-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine
SMILESCc1cccc(Nc2cnc([C@@H]3CCCN(S(=O)(=O)C(C)C)C3)cn2)n1
InChIInChI=1S/C18H25N5O2S/c1-13(2)26(24,25)23-9-5-7-15(12-23)16-10-20-18(11-19-16)22-17-8-4-6-14(3)21-17/h4,6,8,10-11,13,15H,5,7,9,12H2,1-3H3,(H,20,21,22)/t15-/m1/s1
InChIKeyAEMWSIKLPWWOQR-OAHLLOKOSA-N
MW375.50 g/mol
LogP2.84
Rot. Bonds5

About N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine

N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine (PubChem CID 95823846) has the molecular formula C18H25N5O2S and a molecular weight of 375.50 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine
PubChem CID95823846
Molecular FormulaC18H25N5O2S
Molecular Weight375.50 g/mol
Exact Mass375.17
IUPAC NameN-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine
SMILESCc1cccc(Nc2cnc([C@@H]3CCCN(S(=O)(=O)C(C)C)C3)cn2)n1
InChIInChI=1S/C18H25N5O2S/c1-13(2)26(24,25)23-9-5-7-15(12-23)16-10-20-18(11-19-16)22-17-8-4-6-14(3)21-17/h4,6,8,10-11,13,15H,5,7,9,12H2,1-3H3,(H,20,21,22)/t15-/m1/s1
InChIKeyAEMWSIKLPWWOQR-OAHLLOKOSA-N
XLogP2.84
TPSA88.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.50
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine with MolForge

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Related Compounds

2-methyl-N-(6-methyl-2-pyridinyl)-6-[(3S)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrimidin-4-amine
CID 95823853
2-methyl-1-[3-[5-[(6-methyl-2-pyridinyl)amino]pyrazin-2-yl]piperidin-1-yl]propan-1-one
CID 110256273
1H-imidazol-5-yl-[(3S)-3-[5-[(6-methyl-2-pyridinyl)amino]pyrazin-2-yl]piperidin-1-yl]methanone
CID 124979263
(3S)-3-[6-[(4,6-dimethylpyrimidin-2-yl)amino]-2-pyridinyl]-N,N-dimethylpiperidine-1-sulfonamide
CID 95835947
N-[6-[1-(1-ethyl-3-methylpyrazol-4-yl)sulfonylpiperidin-3-yl]-3-pyridinyl]-6-methylpyridin-2-amine
CID 110252348
N-cyclopentyl-6-(1-methylsulfonylpiperidin-3-yl)pyridin-2-amine
CID 110257261
5-(1-propan-2-ylpiperidin-3-yl)-N-pyrimidin-2-ylpyrazin-2-amine
CID 110256171
N-[6-[(3R)-1-(3,4-dimethylphenyl)sulfonylpiperidin-3-yl]-2-pyridinyl]pyrazin-2-amine
CID 124964128
6-(1-methylsulfonylpiperidin-3-yl)-N-pyridin-2-ylpyrazin-2-amine
CID 110252903
N,N-diethyl-2-[(3S)-3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide
CID 95813548
5-(1-ethylpiperidin-3-yl)-N-pyridin-2-ylpyrazin-2-amine
CID 110256139
2-methyl-4-(1-propan-2-ylsulfonylpyrrolidin-3-yl)pyrimidine
CID 110269928

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine?
The IUPAC name of N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine (CID 95823846) is N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine is Cc1cccc(Nc2cnc([C@@H]3CCCN(S(=O)(=O)C(C)C)C3)cn2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine?
The InChIKey is AEMWSIKLPWWOQR-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H25N5O2S/c1-13(2)26(24,25)23-9-5-7-15(12-23)16-10-20-18(11-19-16)22-17-8-4-6-14(3)21-17/h4,6,8,10-11,13,15H,5,7,9,12H2,1-3H3,(H,20,21,22)/t15-/m1/s1.
What are the key properties of N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine?
N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine has a molecular weight of 375.50 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-5-[(3R)-1-propan-2-ylsulfonylpiperidin-3-yl]pyrazin-2-amine is sourced from PubChem (CID 95823846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).