1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide

C14H18Cl2N2O3S — CID 40630200

IUPAC1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide
SMILESCCNC(=O)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1
InChIInChI=1S/C14H18Cl2N2O3S/c1-2-17-14(19)10-6-8-18(9-7-10)22(20,21)13-11(15)4-3-5-12(13)16/h3-5,10H,2,6-9H2,1H3,(H,17,19)
InChIKeyKHYBUNSUHBURHJ-UHFFFAOYSA-N
MW365.28 g/mol
LogP2.53
Rot. Bonds4

About 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide

1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide (PubChem CID 40630200) has the molecular formula C14H18Cl2N2O3S and a molecular weight of 365.28 g/mol. Its IUPAC name is 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide
PubChem CID40630200
Molecular FormulaC14H18Cl2N2O3S
Molecular Weight365.28 g/mol
Exact Mass364.04
IUPAC Name1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide
SMILESCCNC(=O)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1
InChIInChI=1S/C14H18Cl2N2O3S/c1-2-17-14(19)10-6-8-18(9-7-10)22(20,21)13-11(15)4-3-5-12(13)16/h3-5,10H,2,6-9H2,1H3,(H,17,19)
InChIKeyKHYBUNSUHBURHJ-UHFFFAOYSA-N
XLogP2.53
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.28
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,6-dichlorophenyl)sulfonyl-N-[(5-ethylthiophen-2-yl)methyl]piperidine-4-carboxamide
CID 46466616
N-ethyl-1-(3-methylphenyl)sulfonylpiperidine-4-carboxamide
CID 110350939
1-(2,6-dichlorophenyl)sulfonyl-N-[2-(dimethylamino)-3-methylbutyl]piperidine-4-carboxamide
CID 24650065
methyl 4-[[[1-(2,6-dichlorophenyl)sulfonylpiperidine-4-carbonyl]amino]methyl]benzoate
CID 46561005
2-[4-[1-(2,6-dichlorophenyl)sulfonylpiperidine-4-carbonyl]piperazin-1-yl]-N-ethylacetamide
CID 55566414
N-ethyl-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide
CID 40630207
1-(2,6-dichlorophenyl)sulfonyl-N-[3-(N-methylanilino)propyl]piperidine-4-carboxamide
CID 27024550
1-[(2-chloro-4-pyridinyl)sulfonyl]-N-ethylpiperidine-4-carboxamide
CID 61045541
1-(2,6-dichlorophenyl)sulfonyl-N-[2-(3-methylpiperidin-1-yl)propyl]piperidine-4-carboxamide
CID 55721126
(2S)-2-[4-(2,6-dichlorophenyl)sulfonylpiperazin-1-yl]-N-ethylpropanamide
CID 8599567
1-(2,6-dichlorophenyl)sulfonyl-N-[(4-pyrazol-1-ylphenyl)methyl]piperidine-4-carboxamide
CID 55711297
1-(benzenesulfonyl)-N-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxamide
CID 18110259

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide?
The IUPAC name of 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide (CID 40630200) is 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide?
The canonical SMILES for 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide is CCNC(=O)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1.
What is the InChIKey of 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide?
The InChIKey is KHYBUNSUHBURHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O3S/c1-2-17-14(19)10-6-8-18(9-7-10)22(20,21)13-11(15)4-3-5-12(13)16/h3-5,10H,2,6-9H2,1H3,(H,17,19).
What are the key properties of 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide?
1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide has a molecular weight of 365.28 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dichlorophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide is sourced from PubChem (CID 40630200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).