2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide

C19H29N3O3 — CID 86914008

IUPAC2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide
SMILESCCOc1ccc(C2CCCN2C(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C19H29N3O3/c1-2-25-17-7-5-16(6-8-17)18-4-3-10-22(18)19(23)20-9-11-21-12-14-24-15-13-21/h5-8,18H,2-4,9-15H2,1H3,(H,20,23)
InChIKeyQENHATILFAXWFD-UHFFFAOYSA-N
MW347.46 g/mol
LogP2.26
Rot. Bonds6

About 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide

2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide (PubChem CID 86914008) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide
PubChem CID86914008
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Name2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide
SMILESCCOc1ccc(C2CCCN2C(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C19H29N3O3/c1-2-25-17-7-5-16(6-8-17)18-4-3-10-22(18)19(23)20-9-11-21-12-14-24-15-13-21/h5-8,18H,2-4,9-15H2,1H3,(H,20,23)
InChIKeyQENHATILFAXWFD-UHFFFAOYSA-N
XLogP2.26
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(1,3-benzodioxol-5-yl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide
CID 95312949
(2S)-2-(4-ethoxyphenyl)-N-(3-pyrazol-1-ylpropyl)pyrrolidine-1-carboxamide
CID 94030721
N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide
CID 47127072
(2R)-N-(5-morpholin-4-ylpentyl)-2-phenylpyrrolidine-1-carboxamide
CID 126450255
(2R)-2-(4-ethoxyphenyl)-N-[3-(1,2,4-triazol-1-yl)propyl]pyrrolidine-1-carboxamide
CID 94058325
(2S)-N-(4-ethoxyphenyl)-2-(4-methylphenyl)pyrrolidine-1-carboxamide
CID 51855939
1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]butan-1-one
CID 134017853
2-(4-methoxyphenyl)-N-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrrolidine-1-carboxamide
CID 136511992
(2S)-2-(4-ethoxyphenyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide
CID 94048522
2-(4-ethoxyphenyl)-N-[[1-(4-fluorophenyl)pyrrolidin-3-yl]methyl]pyrrolidine-1-carboxamide
CID 60583588
N-(2-bromophenyl)-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide
CID 86986350
tert-butyl N-[4-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-4-oxobutyl]carbamate
CID 51257063

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide?
The IUPAC name of 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide (CID 86914008) is 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide?
The canonical SMILES for 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide is CCOc1ccc(C2CCCN2C(=O)NCCN2CCOCC2)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide?
The InChIKey is QENHATILFAXWFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c1-2-25-17-7-5-16(6-8-17)18-4-3-10-22(18)19(23)20-9-11-21-12-14-24-15-13-21/h5-8,18H,2-4,9-15H2,1H3,(H,20,23).
What are the key properties of 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide?
2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide has a molecular weight of 347.46 g/mol, XLogP of 2.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 86914008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).