N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide

C18H22N2O2 — CID 53080886

IUPACN-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide
SMILESO=C(NC1CCCC1)c1ccc2c(c1)CCN2C(=O)C1CC1
InChIInChI=1S/C18H22N2O2/c21-17(19-15-3-1-2-4-15)14-7-8-16-13(11-14)9-10-20(16)18(22)12-5-6-12/h7-8,11-12,15H,1-6,9-10H2,(H,19,21)
InChIKeyBEXWOVSVTWNFIL-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.66
Rot. Bonds3

About N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide

N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide (PubChem CID 53080886) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide
PubChem CID53080886
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide
SMILESO=C(NC1CCCC1)c1ccc2c(c1)CCN2C(=O)C1CC1
InChIInChI=1S/C18H22N2O2/c21-17(19-15-3-1-2-4-15)14-7-8-16-13(11-14)9-10-20(16)18(22)12-5-6-12/h7-8,11-12,15H,1-6,9-10H2,(H,19,21)
InChIKeyBEXWOVSVTWNFIL-UHFFFAOYSA-N
XLogP2.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-3-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]urea
CID 112506054
methyl 1-(cyclohexanecarbonyl)-2,3-dihydroindole-5-carboxylate
CID 86917335
1-(cyclopropanecarbonyl)-N-(3,5-dimethylphenyl)-2,3-dihydroindole-5-carboxamide
CID 53080907
4-(1-acetyl-2,3-dihydroindol-5-yl)-N-cycloheptylbenzamide
CID 53043799
2-bromo-1-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]ethanone
CID 82258607
N-cyclohexyl-1-propanoyl-2,3-dihydroindole-6-carboxamide
CID 53014606
N-cycloheptyl-3-[[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]sulfonylamino]propanamide
CID 46361186
N-(1,3-benzodioxol-5-yl)-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide
CID 53080913
2-bromo-1-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]propan-1-one;ethane
CID 170705246
1-acetyl-N-(8-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydroindole-5-carboxamide
CID 119260114
1-[1-(cyclohexanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]ethanone
CID 110737681
(3S)-N-cyclooctyl-3-[[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]sulfonyl]butanamide
CID 92708682

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide?
The IUPAC name of N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide (CID 53080886) is N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide is O=C(NC1CCCC1)c1ccc2c(c1)CCN2C(=O)C1CC1.
What is the InChIKey of N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide?
The InChIKey is BEXWOVSVTWNFIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c21-17(19-15-3-1-2-4-15)14-7-8-16-13(11-14)9-10-20(16)18(22)12-5-6-12/h7-8,11-12,15H,1-6,9-10H2,(H,19,21).
What are the key properties of N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide?
N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide has a molecular weight of 298.39 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 53080886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).