(3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide

C25H30N4O3 — CID 52909261

IUPAC(3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCn1c2ccccc2c2cc(NC(=O)[C@@H]3CC(=O)N(CCN4CCOCC4)C3)ccc21
InChIInChI=1S/C25H30N4O3/c1-2-29-22-6-4-3-5-20(22)21-16-19(7-8-23(21)29)26-25(31)18-15-24(30)28(17-18)10-9-27-11-13-32-14-12-27/h3-8,16,18H,2,9-15,17H2,1H3,(H,26,31)/t18-/m1/s1
InChIKeyVJTWIAVSMMUTNN-GOSISDBHSA-N
MW434.54 g/mol
LogP2.93
Rot. Bonds6

About (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide

(3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 52909261) has the molecular formula C25H30N4O3 and a molecular weight of 434.54 g/mol. Its IUPAC name is (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID52909261
Molecular FormulaC25H30N4O3
Molecular Weight434.54 g/mol
Exact Mass434.23
IUPAC Name(3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCn1c2ccccc2c2cc(NC(=O)[C@@H]3CC(=O)N(CCN4CCOCC4)C3)ccc21
InChIInChI=1S/C25H30N4O3/c1-2-29-22-6-4-3-5-20(22)21-16-19(7-8-23(21)29)26-25(31)18-15-24(30)28(17-18)10-9-27-11-13-32-14-12-27/h3-8,16,18H,2,9-15,17H2,1H3,(H,26,31)/t18-/m1/s1
InChIKeyVJTWIAVSMMUTNN-GOSISDBHSA-N
XLogP2.93
TPSA66.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.54
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide with MolForge

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Related Compounds

N-(9-ethylcarbazol-3-yl)-1-(2-hydroxy-2-phenylethyl)-5-oxopyrrolidine-3-carboxamide
CID 10151399
N-(9-ethylcarbazol-3-yl)-1-methyl-2-oxopiperidine-4-carboxamide
CID 71898551
1-[2-(2,4-dimethoxyphenyl)ethyl]-N-(9-ethylcarbazol-3-yl)-5-oxopyrrolidine-3-carboxamide
CID 174466279
N-(2,5-dimethylphenyl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide
CID 113182982
[2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl] 5-oxo-1-(2-phenylethyl)pyrrolidine-3-carboxylate
CID 4833132
N-(2-methyl-6-propan-2-ylphenyl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide
CID 113182995
(3R)-1-(2-morpholin-4-ylethyl)-5-oxo-N-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide
CID 95046533
4-[(9-ethylcarbazol-3-yl)carbamoyl]oxane-4-carboxylic acid
CID 167766906
trans-(1S,2S)-1-N,2-N-bis(9-ethylcarbazol-3-yl)-3-methylidenecyclopropane-1,2-dicarboxamide
CID 2321929
1-(2-methoxyethyl)-N-[4-(morpholin-4-ylmethyl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 108730979
1-[(4-chlorophenyl)methyl]-N-(9-ethylcarbazol-3-yl)piperidine-3-carboxamide
CID 43926053
(3S)-1-[(2-chlorophenyl)methyl]-N-(9-ethylcarbazol-3-yl)piperidine-3-carboxamide
CID 38104218

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide (CID 52909261) is (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide is CCn1c2ccccc2c2cc(NC(=O)[C@@H]3CC(=O)N(CCN4CCOCC4)C3)ccc21.
What is the InChIKey of (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is VJTWIAVSMMUTNN-GOSISDBHSA-N. The full InChI is InChI=1S/C25H30N4O3/c1-2-29-22-6-4-3-5-20(22)21-16-19(7-8-23(21)29)26-25(31)18-15-24(30)28(17-18)10-9-27-11-13-32-14-12-27/h3-8,16,18H,2,9-15,17H2,1H3,(H,26,31)/t18-/m1/s1.
What are the key properties of (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide?
(3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 434.54 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 52909261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).