N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C20H28N2O3 — CID 125143847

IUPACN-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOCC1(CCNC(=O)Cc2cccc(N3CCCC3=O)c2)CCC1
InChIInChI=1S/C20H28N2O3/c1-25-15-20(8-4-9-20)10-11-21-18(23)14-16-5-2-6-17(13-16)22-12-3-7-19(22)24/h2,5-6,13H,3-4,7-12,14-15H2,1H3,(H,21,23)
InChIKeyYDJKKZBNRLWFGP-UHFFFAOYSA-N
MW344.45 g/mol
LogP2.68
Rot. Bonds8

About N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide

N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 125143847) has the molecular formula C20H28N2O3 and a molecular weight of 344.45 g/mol. Its IUPAC name is N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID125143847
Molecular FormulaC20H28N2O3
Molecular Weight344.45 g/mol
Exact Mass344.21
IUPAC NameN-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOCC1(CCNC(=O)Cc2cccc(N3CCCC3=O)c2)CCC1
InChIInChI=1S/C20H28N2O3/c1-25-15-20(8-4-9-20)10-11-21-18(23)14-16-5-2-6-17(13-16)22-12-3-7-19(22)24/h2,5-6,13H,3-4,7-12,14-15H2,1H3,(H,21,23)
InChIKeyYDJKKZBNRLWFGP-UHFFFAOYSA-N
XLogP2.68
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.45
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methoxymethyl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 120622513
1-[3-(methoxymethyl)phenyl]pyrrolidin-2-one
CID 58826741
N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 154838852
1-[3-(ethylaminomethyl)phenyl]pyrrolidin-2-one
CID 63272633
3,3-dimethyl-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]butanamide
CID 39004153
4-(2-oxopyrrolidin-1-yl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 39003599
N-[[4-(methoxymethyl)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 46416010
4-amino-3-methoxy-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]butanamide;hydrochloride
CID 120588846
methyl (2S)-1-[2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetyl]piperidine-2-carboxylate
CID 125139186
3-(4-methoxy-3-methylphenyl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide
CID 100526543
4-[[[3-(2-oxopyrrolidin-1-yl)phenyl]methylamino]methyl]benzoic acid
CID 122030295
N-(2-hydroxyethyl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 78823345

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 125143847) is N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide is COCC1(CCNC(=O)Cc2cccc(N3CCCC3=O)c2)CCC1.
What is the InChIKey of N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is YDJKKZBNRLWFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O3/c1-25-15-20(8-4-9-20)10-11-21-18(23)14-16-5-2-6-17(13-16)22-12-3-7-19(22)24/h2,5-6,13H,3-4,7-12,14-15H2,1H3,(H,21,23).
What are the key properties of N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 344.45 g/mol, XLogP of 2.68, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 125143847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).