N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C23H26N2O3 — CID 9299632

IUPACN-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOc1ccc(CN(C(=O)Cc2ccc(N3CCCC3=O)cc2)C2CC2)cc1
InChIInChI=1S/C23H26N2O3/c1-28-21-12-6-18(7-13-21)16-25(20-10-11-20)23(27)15-17-4-8-19(9-5-17)24-14-2-3-22(24)26/h4-9,12-13,20H,2-3,10-11,14-16H2,1H3
InChIKeyBYOSGPYXMSYKPF-UHFFFAOYSA-N
MW378.47 g/mol
LogP3.56
Rot. Bonds7

About N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide

N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 9299632) has the molecular formula C23H26N2O3 and a molecular weight of 378.47 g/mol. Its IUPAC name is N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID9299632
Molecular FormulaC23H26N2O3
Molecular Weight378.47 g/mol
Exact Mass378.19
IUPAC NameN-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOc1ccc(CN(C(=O)Cc2ccc(N3CCCC3=O)cc2)C2CC2)cc1
InChIInChI=1S/C23H26N2O3/c1-28-21-12-6-18(7-13-21)16-25(20-10-11-20)23(27)15-17-4-8-19(9-5-17)24-14-2-3-22(24)26/h4-9,12-13,20H,2-3,10-11,14-16H2,1H3
InChIKeyBYOSGPYXMSYKPF-UHFFFAOYSA-N
XLogP3.56
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.47
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide
CID 38371529
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 31425201
N-[(4-methoxyphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 51240858
N-(4-methoxyphenyl)-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9042283
1-[4-[2-[(2S)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]phenyl]pyrrolidin-2-one
CID 26703248
1-(4-methoxyphenyl)azepan-2-one
CID 66742326
N-benzyl-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 27666071
N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)-N-[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]acetamide
CID 23512961
[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethyl] 2-(2-oxoazepan-1-yl)acetate
CID 55401551
2-tert-butylsulfanyl-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]acetamide
CID 134052775
N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9469985
2-hydroxypropane-1,2,3-tricarboxylic acid;1-[4-[[(4-methoxyphenyl)methyl-(oxolan-2-ylmethyl)amino]methyl]phenyl]pyrrolidin-2-one
CID 171670363

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 9299632) is N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide is COc1ccc(CN(C(=O)Cc2ccc(N3CCCC3=O)cc2)C2CC2)cc1.
What is the InChIKey of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is BYOSGPYXMSYKPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O3/c1-28-21-12-6-18(7-13-21)16-25(20-10-11-20)23(27)15-17-4-8-19(9-5-17)24-14-2-3-22(24)26/h4-9,12-13,20H,2-3,10-11,14-16H2,1H3.
What are the key properties of N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 378.47 g/mol, XLogP of 3.56, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 9299632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).