1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine

C15H25N3O4S — CID 141059153

IUPAC1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine
SMILESCCN1CCN(S(=O)(=O)c2ccc(O[C@H](C)COC)nc2)CC1
InChIInChI=1S/C15H25N3O4S/c1-4-17-7-9-18(10-8-17)23(19,20)14-5-6-15(16-11-14)22-13(2)12-21-3/h5-6,11,13H,4,7-10,12H2,1-3H3/t13-/m1/s1
InChIKeyDQWSODDCRCUWIR-CYBMUJFWSA-N
MW343.45 g/mol
LogP0.82
Rot. Bonds7

About 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine

1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine (PubChem CID 141059153) has the molecular formula C15H25N3O4S and a molecular weight of 343.45 g/mol. Its IUPAC name is 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine.

Molecular Properties

Compound Name1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine
PubChem CID141059153
Molecular FormulaC15H25N3O4S
Molecular Weight343.45 g/mol
Exact Mass343.16
IUPAC Name1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine
SMILESCCN1CCN(S(=O)(=O)c2ccc(O[C@H](C)COC)nc2)CC1
InChIInChI=1S/C15H25N3O4S/c1-4-17-7-9-18(10-8-17)23(19,20)14-5-6-15(16-11-14)22-13(2)12-21-3/h5-6,11,13H,4,7-10,12H2,1-3H3/t13-/m1/s1
InChIKeyDQWSODDCRCUWIR-CYBMUJFWSA-N
XLogP0.82
TPSA71.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine with MolForge

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Related Compounds

6-(1-methoxypropan-2-yloxy)pyridine-3-sulfonyl chloride
CID 112572758
2-propan-2-yloxy-5-pyrrolidin-1-ylsulfonylpyridine
CID 5268219
[5-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]methanamine
CID 114613052
N-ethyl-5-(4-ethylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 62149616
5-(4-ethylpiperazin-1-yl)sulfonylpyrimidin-2-amine
CID 46360864
1-ethyl-4-(4-methoxyphenyl)sulfonylpiperazine
CID 843240
2-ethoxy-5-piperidin-1-ylsulfonylpyridine
CID 5268013
2-methoxy-5-piperidin-1-ylsulfonylpyridine
CID 5268012
7-(4-ethylpiperazin-1-yl)-5-[6-(1-methoxypropan-2-yloxy)-3-pyridinyl]thieno[2,3-c]pyridine
CID 20720222
1-[(6-methoxy-3-pyridinyl)sulfonyl]piperidin-4-one
CID 69088398
1-ethyl-4-(3-fluoro-4-methoxyphenyl)sulfonylpiperazine
CID 39730317
5-(4-ethylpiperazin-1-yl)sulfonyl-2-(2-methoxyethoxy)pyridine-3-carboxamide
CID 141012525

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine?
The IUPAC name of 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine (CID 141059153) is 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine.
What is the SMILES notation for 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine?
The canonical SMILES for 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine is CCN1CCN(S(=O)(=O)c2ccc(O[C@H](C)COC)nc2)CC1.
What is the InChIKey of 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine?
The InChIKey is DQWSODDCRCUWIR-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H25N3O4S/c1-4-17-7-9-18(10-8-17)23(19,20)14-5-6-15(16-11-14)22-13(2)12-21-3/h5-6,11,13H,4,7-10,12H2,1-3H3/t13-/m1/s1.
What are the key properties of 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine?
1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine has a molecular weight of 343.45 g/mol, XLogP of 0.82, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[[6-[(2R)-1-methoxypropan-2-yl]oxy-3-pyridinyl]sulfonyl]piperazine is sourced from PubChem (CID 141059153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).