(2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide

C18H26N2O — CID 67191919

IUPAC(2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide
SMILESC[C@H]1Cc2ccccc2N1C(=O)NC1CCCCCCC1
InChIInChI=1S/C18H26N2O/c1-14-13-15-9-7-8-12-17(15)20(14)18(21)19-16-10-5-3-2-4-6-11-16/h7-9,12,14,16H,2-6,10-11,13H2,1H3,(H,19,21)/t14-/m0/s1
InChIKeyMENMBGMKOMHUNW-AWEZNQCLSA-N
MW286.42 g/mol
LogP4.26
Rot. Bonds1

About (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide

(2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide (PubChem CID 67191919) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound Name(2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide
PubChem CID67191919
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name(2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide
SMILESC[C@H]1Cc2ccccc2N1C(=O)NC1CCCCCCC1
InChIInChI=1S/C18H26N2O/c1-14-13-15-9-7-8-12-17(15)20(14)18(21)19-16-10-5-3-2-4-6-11-16/h7-9,12,14,16H,2-6,10-11,13H2,1H3,(H,19,21)/t14-/m0/s1
InChIKeyMENMBGMKOMHUNW-AWEZNQCLSA-N
XLogP4.26
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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N-(1-benzylpiperidin-3-yl)-2-methyl-2,3-dihydroindole-1-carboxamide
CID 112824331
N-cyclohexyl-3-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide
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N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 22200030
(2R)-N-cyclopropyl-2-methyl-2,3-dihydroindole-1-carbothioamide
CID 8619560
N-cycloheptyl-3-(2-methyl-2,3-dihydroindol-1-yl)propanamide
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(2R)-2-methyl-N-[(3S)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2,3-dihydroindole-1-carboxamide
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[6-(cyclohexylamino)pyridazin-3-yl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109112959
(2S)-N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-methyl-2,3-dihydroindole-1-carboxamide
CID 7548134
N-cyclohexyl-2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2,3-dihydroindole-1-carboxamide
CID 110875587
(2S)-N-[(3S)-1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]-2-methyl-2,3-dihydroindole-1-carboxamide
CID 7549116

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide?
The IUPAC name of (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide (CID 67191919) is (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide is C[C@H]1Cc2ccccc2N1C(=O)NC1CCCCCCC1.
What is the InChIKey of (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide?
The InChIKey is MENMBGMKOMHUNW-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H26N2O/c1-14-13-15-9-7-8-12-17(15)20(14)18(21)19-16-10-5-3-2-4-6-11-16/h7-9,12,14,16H,2-6,10-11,13H2,1H3,(H,19,21)/t14-/m0/s1.
What are the key properties of (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide?
(2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 4.26, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 67191919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).