N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine

C14H24N4O2S — CID 62148584

IUPACN-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
SMILESCCCN1CCN(S(=O)(=O)c2cccnc2NCC)CC1
InChIInChI=1S/C14H24N4O2S/c1-3-8-17-9-11-18(12-10-17)21(19,20)13-6-5-7-16-14(13)15-4-2/h5-7H,3-4,8-12H2,1-2H3,(H,15,16)
InChIKeyHXOMWQLUEXDGJT-UHFFFAOYSA-N
MW312.44 g/mol
LogP1.23
Rot. Bonds6

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

N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine (PubChem CID 62148584) has the molecular formula C14H24N4O2S and a molecular weight of 312.44 g/mol. Its IUPAC name is N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
PubChem CID62148584
Molecular FormulaC14H24N4O2S
Molecular Weight312.44 g/mol
Exact Mass312.16
IUPAC NameN-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
SMILESCCCN1CCN(S(=O)(=O)c2cccnc2NCC)CC1
InChIInChI=1S/C14H24N4O2S/c1-3-8-17-9-11-18(12-10-17)21(19,20)13-6-5-7-16-14(13)15-4-2/h5-7H,3-4,8-12H2,1-2H3,(H,15,16)
InChIKeyHXOMWQLUEXDGJT-UHFFFAOYSA-N
XLogP1.23
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-3-(4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 55043901
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]-4-methylpiperidin-4-ol
CID 81108237
3-(4-ethylpiperazin-1-yl)sulfonyl-N-methylpyridin-2-amine
CID 55044035
N-ethyl-3-(4-ethyl-3-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 63605654
3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine
CID 62150305
2-[4-[[2-(methylamino)-3-pyridinyl]sulfonyl]-1,4-diazepan-1-yl]ethanol
CID 107226271
N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
CID 62148841
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]-4-methylpiperidin-3-ol
CID 102964473
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol
CID 55043660
2-[4-[(2-hydrazinyl-3-pyridinyl)sulfonyl]-1,4-diazepan-1-yl]ethanol
CID 107223459
3-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylsulfonyl)-N-ethylpyridin-2-amine
CID 82752813
N-ethyl-3-[3-(methoxymethyl)piperidin-1-yl]sulfonylpyridin-2-amine
CID 106588741

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine?
The IUPAC name of N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine (CID 62148584) is N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine.
What is the SMILES notation for N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine?
The canonical SMILES for N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine is CCCN1CCN(S(=O)(=O)c2cccnc2NCC)CC1.
What is the InChIKey of N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine?
The InChIKey is HXOMWQLUEXDGJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2S/c1-3-8-17-9-11-18(12-10-17)21(19,20)13-6-5-7-16-14(13)15-4-2/h5-7H,3-4,8-12H2,1-2H3,(H,15,16).
What are the key properties of N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine?
N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine has a molecular weight of 312.44 g/mol, XLogP of 1.23, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine is sourced from PubChem (CID 62148584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).