(2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide

C15H18N2O3 — CID 40805057

IUPAC(2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide
SMILESCCN1C(=O)Cc2cc(NC(=O)[C@@H]3CCCO3)ccc21
InChIInChI=1S/C15H18N2O3/c1-2-17-12-6-5-11(8-10(12)9-14(17)18)16-15(19)13-4-3-7-20-13/h5-6,8,13H,2-4,7,9H2,1H3,(H,16,19)/t13-/m0/s1
InChIKeyHCQDTHYONRSOSD-ZDUSSCGKSA-N
MW274.32 g/mol
LogP1.71
Rot. Bonds3

About (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide

(2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide (PubChem CID 40805057) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide
PubChem CID40805057
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name(2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide
SMILESCCN1C(=O)Cc2cc(NC(=O)[C@@H]3CCCO3)ccc21
InChIInChI=1S/C15H18N2O3/c1-2-17-12-6-5-11(8-10(12)9-14(17)18)16-15(19)13-4-3-7-20-13/h5-6,8,13H,2-4,7,9H2,1H3,(H,16,19)/t13-/m0/s1
InChIKeyHCQDTHYONRSOSD-ZDUSSCGKSA-N
XLogP1.71
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-methyl-4-[(3S)-3-[(2S)-2-methylpyrrolidin-1-yl]pyrrolidin-1-yl]phenyl]oxolane-2-carboxamide
CID 59401860
(2,3-Dihydro-indol-1-yl)-(tetrahydro-furan-2-yl)-methanone
CID 651377
N-[3-(2-methylpropylcarbamoyl)phenyl]oxolane-2-carboxamide
CID 2977042
N-[4-({[4-(diethylamino)-2-methylphenyl]amino}carbonyl)phenyl]tetrahydrofuran-2-carboxamide
CID 3242527
N-[2-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]oxolane-2-carboxamide
CID 72274301
N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]oxolane-2-carboxamide
CID 72547466
[3-(2,3-Dihydroindol-1-yl)-3-oxopropyl]-ethyl-(oxolan-2-ylmethyl)azanium
CID 57340645
3-(2-oxopyrrolidin-1-yl)-N-(tetrahydrofuran-2-ylmethyl)benzamide
CID 3245557
N-(2-cyclohexyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)tetrahydro-2-furancarboxamide
CID 2977127
4-methyl-3-(2-oxopyrrolidin-1-yl)-N-(tetrahydrofuran-2-ylmethyl)benzamide
CID 3242801
7ZX8889Bhs
CID 11609163
2-(4-fluorophenyl)-N-(1-(tetrahydrofuran-2-carbonyl)indolin-6-yl)acetamide
CID 44042385

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide?
The IUPAC name of (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide (CID 40805057) is (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide is CCN1C(=O)Cc2cc(NC(=O)[C@@H]3CCCO3)ccc21.
What is the InChIKey of (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide?
The InChIKey is HCQDTHYONRSOSD-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-2-17-12-6-5-11(8-10(12)9-14(17)18)16-15(19)13-4-3-7-20-13/h5-6,8,13H,2-4,7,9H2,1H3,(H,16,19)/t13-/m0/s1.
What are the key properties of (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide?
(2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(1-ethyl-2-oxo-3H-indol-5-yl)oxolane-2-carboxamide is sourced from PubChem (CID 40805057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).