1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide

C19H23N3O2 — CID 96997257

IUPAC1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide
SMILESCCn1c(C)cc(C(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3)c1C
InChIInChI=1S/C19H23N3O2/c1-5-22-11(2)8-16(13(22)4)19(24)20-12(3)14-6-7-17-15(9-14)10-18(23)21-17/h6-9,12H,5,10H2,1-4H3,(H,20,24)(H,21,23)/t12-/m1/s1
InChIKeyFHRYRPYYDWEIGH-GFCCVEGCSA-N
MW325.41 g/mol
LogP3.11
Rot. Bonds4

About 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide

1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide (PubChem CID 96997257) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide
PubChem CID96997257
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide
SMILESCCn1c(C)cc(C(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3)c1C
InChIInChI=1S/C19H23N3O2/c1-5-22-11(2)8-16(13(22)4)19(24)20-12(3)14-6-7-17-15(9-14)10-18(23)21-17/h6-9,12H,5,10H2,1-4H3,(H,20,24)(H,21,23)/t12-/m1/s1
InChIKeyFHRYRPYYDWEIGH-GFCCVEGCSA-N
XLogP3.11
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide with MolForge

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Related Compounds

N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-ethyl-2,5-dimethylpyrrole-3-carboxamide
CID 24630049
2-methyl-3-(methylamino)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propanamide
CID 119736221
2-amino-2-(4-methylphenyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]acetamide
CID 120667587
7-amino-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]heptanamide
CID 119736199
N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-2-phenylquinoline-4-carboxamide
CID 166179805
3-oxo-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-4H-1,4-benzothiazine-6-carboxamide
CID 51118129
1-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-3-[(2S)-1-pyrazol-1-ylpropan-2-yl]urea
CID 94031015
5-nitro-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]thiophene-2-carboxamide
CID 71940657
N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-3-phenylfuran-2-carboxamide
CID 154774789
2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 119736222
2-[(1-ethyl-2,5-dimethylpyrrole-3-carbonyl)amino]propanoic acid
CID 119349121
1-amino-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119296412

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide?
The IUPAC name of 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide (CID 96997257) is 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide.
What is the SMILES notation for 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide?
The canonical SMILES for 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide is CCn1c(C)cc(C(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3)c1C.
What is the InChIKey of 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide?
The InChIKey is FHRYRPYYDWEIGH-GFCCVEGCSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-5-22-11(2)8-16(13(22)4)19(24)20-12(3)14-6-7-17-15(9-14)10-18(23)21-17/h6-9,12H,5,10H2,1-4H3,(H,20,24)(H,21,23)/t12-/m1/s1.
What are the key properties of 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide?
1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,5-dimethyl-N-[(1R)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]pyrrole-3-carboxamide is sourced from PubChem (CID 96997257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).