4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine

C12H20N4O2S — CID 63603562

IUPAC4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
SMILESCCC1CN(S(=O)(=O)c2ccnc(N)c2)CCN1C
InChIInChI=1S/C12H20N4O2S/c1-3-10-9-16(7-6-15(10)2)19(17,18)11-4-5-14-12(13)8-11/h4-5,8,10H,3,6-7,9H2,1-2H3,(H2,13,14)
InChIKeySRNHVMMPTSGXRW-UHFFFAOYSA-N
MW284.38 g/mol
LogP0.38
Rot. Bonds3

About 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine

4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine (PubChem CID 63603562) has the molecular formula C12H20N4O2S and a molecular weight of 284.38 g/mol. Its IUPAC name is 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine.

Molecular Properties

Compound Name4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
PubChem CID63603562
Molecular FormulaC12H20N4O2S
Molecular Weight284.38 g/mol
Exact Mass284.13
IUPAC Name4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
SMILESCCC1CN(S(=O)(=O)c2ccnc(N)c2)CCN1C
InChIInChI=1S/C12H20N4O2S/c1-3-10-9-16(7-6-15(10)2)19(17,18)11-4-5-14-12(13)8-11/h4-5,8,10H,3,6-7,9H2,1-2H3,(H2,13,14)
InChIKeySRNHVMMPTSGXRW-UHFFFAOYSA-N
XLogP0.38
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-ethyl-3-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 63605128
3-chloro-5-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 64600354
4-(3-propylpyrrolidin-1-yl)sulfonylpyridin-2-amine
CID 113418711
[5-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyrimidin-2-yl]hydrazine
CID 63621762
2-[4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylphenyl]ethanamine
CID 63621930
1-[3-(3-ethyl-4-methylpiperazin-1-yl)sulfonylphenyl]ethanone
CID 63620570
4-(4-propylpiperidin-1-yl)sulfonylpyridin-2-amine
CID 62206687
4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylbenzoic acid
CID 63611082
5-(3-ethyl-4-methylpiperazin-1-yl)sulfonylthiophen-3-amine
CID 63605065
5-(3-ethyl-4-methylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one
CID 63616386
1-[4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylphenyl]ethanol
CID 63615234
4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine
CID 62152115

Frequently Asked Questions

What is the IUPAC name of 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine?
The IUPAC name of 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine (CID 63603562) is 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine.
What is the SMILES notation for 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine?
The canonical SMILES for 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine is CCC1CN(S(=O)(=O)c2ccnc(N)c2)CCN1C.
What is the InChIKey of 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine?
The InChIKey is SRNHVMMPTSGXRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2S/c1-3-10-9-16(7-6-15(10)2)19(17,18)11-4-5-14-12(13)8-11/h4-5,8,10H,3,6-7,9H2,1-2H3,(H2,13,14).
What are the key properties of 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine?
4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine has a molecular weight of 284.38 g/mol, XLogP of 0.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine is sourced from PubChem (CID 63603562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).