2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide

C15H24N4O3S — CID 133383079

IUPAC2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNc1ncccc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C15H24N4O3S/c1-2-8-16-14(20)12-18-15-13(7-6-9-17-15)23(21,22)19-10-4-3-5-11-19/h6-7,9H,2-5,8,10-12H2,1H3,(H,16,20)(H,17,18)
InChIKeyQAVFTDFRXPOZPA-UHFFFAOYSA-N
MW340.45 g/mol
LogP1.19
Rot. Bonds7

About 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide

2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide (PubChem CID 133383079) has the molecular formula C15H24N4O3S and a molecular weight of 340.45 g/mol. Its IUPAC name is 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide
PubChem CID133383079
Molecular FormulaC15H24N4O3S
Molecular Weight340.45 g/mol
Exact Mass340.16
IUPAC Name2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNc1ncccc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C15H24N4O3S/c1-2-8-16-14(20)12-18-15-13(7-6-9-17-15)23(21,22)19-10-4-3-5-11-19/h6-7,9H,2-5,8,10-12H2,1H3,(H,16,20)(H,17,18)
InChIKeyQAVFTDFRXPOZPA-UHFFFAOYSA-N
XLogP1.19
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine
CID 62150305
2-[[3-(piperidine-1-carbonyl)-2-pyridinyl]amino]-N-propylacetamide
CID 133383039
2-[(3-chloro-2-pyridinyl)amino]-N-propylacetamide
CID 43402545
3-(1,4-oxazepan-4-ylsulfonyl)-N-propylpyridin-2-amine
CID 62966790
3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylsulfonyl)-N-propylpyridin-2-amine
CID 115561614
N-(2-cycloheptyloxyethyl)-3-piperidin-1-ylsulfonylpyridin-2-amine
CID 133308692
N-ethyl-3-(4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 55043901
N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 62148584
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]-4-methylpiperidin-4-ol
CID 81108237
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol
CID 55043660
N'-(3-piperidin-1-ylsulfonyl-2-pyridinyl)-N-quinolin-2-ylethane-1,2-diamine
CID 133309762
2-[4-[[2-(methylamino)-3-pyridinyl]sulfonyl]-1,4-diazepan-1-yl]ethanol
CID 107226271

Frequently Asked Questions

What is the IUPAC name of 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide?
The IUPAC name of 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide (CID 133383079) is 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide.
What is the SMILES notation for 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide?
The canonical SMILES for 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide is CCCNC(=O)CNc1ncccc1S(=O)(=O)N1CCCCC1.
What is the InChIKey of 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide?
The InChIKey is QAVFTDFRXPOZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3S/c1-2-8-16-14(20)12-18-15-13(7-6-9-17-15)23(21,22)19-10-4-3-5-11-19/h6-7,9H,2-5,8,10-12H2,1H3,(H,16,20)(H,17,18).
What are the key properties of 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide?
2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide has a molecular weight of 340.45 g/mol, XLogP of 1.19, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide is sourced from PubChem (CID 133383079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).