2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide

C18H26N2O4 — CID 94620134

IUPAC2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide
SMILESCC[C@H](NC(=O)COC)c1ccccc1OCC(=O)N1CCCC1
InChIInChI=1S/C18H26N2O4/c1-3-15(19-17(21)12-23-2)14-8-4-5-9-16(14)24-13-18(22)20-10-6-7-11-20/h4-5,8-9,15H,3,6-7,10-13H2,1-2H3,(H,19,21)/t15-/m0/s1
InChIKeyCCHJYJHXCMLFQH-HNNXBMFYSA-N
MW334.42 g/mol
LogP1.90
Rot. Bonds8

About 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide

2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide (PubChem CID 94620134) has the molecular formula C18H26N2O4 and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide
PubChem CID94620134
Molecular FormulaC18H26N2O4
Molecular Weight334.42 g/mol
Exact Mass334.19
IUPAC Name2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide
SMILESCC[C@H](NC(=O)COC)c1ccccc1OCC(=O)N1CCCC1
InChIInChI=1S/C18H26N2O4/c1-3-15(19-17(21)12-23-2)14-8-4-5-9-16(14)24-13-18(22)20-10-6-7-11-20/h4-5,8-9,15H,3,6-7,10-13H2,1-2H3,(H,19,21)/t15-/m0/s1
InChIKeyCCHJYJHXCMLFQH-HNNXBMFYSA-N
XLogP1.90
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methylphenoxy)-N-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide
CID 55901922
N-[2-oxo-2-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propylamino]ethyl]-2-phenylacetamide
CID 55958604
2-(oxolan-2-yl)-N-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide
CID 51121409
3-(4-fluorophenyl)sulfanyl-N-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]propanamide
CID 55902042
2-amino-N-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]pentanamide;hydrochloride
CID 119288275
3-(4-methylphenyl)sulfonyl-N-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]propanamide
CID 55901152
3,4-dichloro-N-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]benzamide
CID 60534577
2,4-difluoro-N-[2-oxo-2-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propylamino]ethyl]benzamide
CID 55958988
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide
CID 55901660
N-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 55902181
2-[2-(1-hydroxyethyl)phenoxy]-1-pyrrolidin-1-ylethanone
CID 43504036
2-(1,3-benzoxazol-2-ylsulfanyl)-N-[1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide
CID 55902043

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide?
The IUPAC name of 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide (CID 94620134) is 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide?
The canonical SMILES for 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide is CC[C@H](NC(=O)COC)c1ccccc1OCC(=O)N1CCCC1.
What is the InChIKey of 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide?
The InChIKey is CCHJYJHXCMLFQH-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H26N2O4/c1-3-15(19-17(21)12-23-2)14-8-4-5-9-16(14)24-13-18(22)20-10-6-7-11-20/h4-5,8-9,15H,3,6-7,10-13H2,1-2H3,(H,19,21)/t15-/m0/s1.
What are the key properties of 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide?
2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide has a molecular weight of 334.42 g/mol, XLogP of 1.90, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(1S)-1-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propyl]acetamide is sourced from PubChem (CID 94620134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).