1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide

C19H27N3O3S — CID 20966183

IUPAC1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(S(=O)(=O)c2ccc3c(ccn3CC)c2)CC1
InChIInChI=1S/C19H27N3O3S/c1-3-10-20-19(23)15-8-12-22(13-9-15)26(24,25)17-5-6-18-16(14-17)7-11-21(18)4-2/h5-7,11,14-15H,3-4,8-10,12-13H2,1-2H3,(H,20,23)
InChIKeyKNAGVAYMEANMQR-UHFFFAOYSA-N
MW377.51 g/mol
LogP2.59
Rot. Bonds6

About 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide

1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide (PubChem CID 20966183) has the molecular formula C19H27N3O3S and a molecular weight of 377.51 g/mol. Its IUPAC name is 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide
PubChem CID20966183
Molecular FormulaC19H27N3O3S
Molecular Weight377.51 g/mol
Exact Mass377.18
IUPAC Name1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(S(=O)(=O)c2ccc3c(ccn3CC)c2)CC1
InChIInChI=1S/C19H27N3O3S/c1-3-10-20-19(23)15-8-12-22(13-9-15)26(24,25)17-5-6-18-16(14-17)7-11-21(18)4-2/h5-7,11,14-15H,3-4,8-10,12-13H2,1-2H3,(H,20,23)
InChIKeyKNAGVAYMEANMQR-UHFFFAOYSA-N
XLogP2.59
TPSA71.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.51
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-ethylindol-5-yl)sulfonyl-N-[3-(4-ethylpiperazin-1-yl)propyl]piperidine-4-carboxamide
CID 20966208
1-(1-ethylindol-5-yl)sulfonyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidine-4-carboxamide
CID 20966193
(3R)-1-(1-ethylindol-5-yl)sulfonyl-N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide
CID 92751290
(3S)-N-(3-ethoxypropyl)-1-(1-ethylindol-5-yl)sulfonylpiperidine-3-carboxamide
CID 92726167
(3R)-1-(1-ethylindol-5-yl)sulfonyl-N-[3-(4-ethylpiperazin-1-yl)propyl]piperidine-3-carboxamide
CID 92751316
(3S)-1-(1-ethylindol-5-yl)sulfonyl-N-(3-methoxypropyl)piperidine-3-carboxamide
CID 92751303
(3R)-1-(1-ethylindol-5-yl)sulfonyl-N-[2-(4-methylphenyl)ethyl]piperidine-3-carboxamide
CID 92751286
1-(3,4-dimethoxyphenyl)sulfonyl-N-propylpiperidine-4-carboxamide
CID 27256239
1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-propylpiperidine-4-carboxamide
CID 26823088
1-(1-ethylindol-5-yl)sulfonyl-N-(2-thiophen-2-ylethyl)piperidine-3-carboxamide
CID 46349864
N-hexyl-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 32645883
N-butyl-1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide
CID 26590850

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide?
The IUPAC name of 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide (CID 20966183) is 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide?
The canonical SMILES for 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide is CCCNC(=O)C1CCN(S(=O)(=O)c2ccc3c(ccn3CC)c2)CC1.
What is the InChIKey of 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide?
The InChIKey is KNAGVAYMEANMQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3S/c1-3-10-20-19(23)15-8-12-22(13-9-15)26(24,25)17-5-6-18-16(14-17)7-11-21(18)4-2/h5-7,11,14-15H,3-4,8-10,12-13H2,1-2H3,(H,20,23).
What are the key properties of 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide?
1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide has a molecular weight of 377.51 g/mol, XLogP of 2.59, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylindol-5-yl)sulfonyl-N-propylpiperidine-4-carboxamide is sourced from PubChem (CID 20966183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).