4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one

C23H27NO4 — CID 10619838

IUPAC4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one
SMILESCOc1ccc(N2CC(c3ccc(OC)c(OC4CCCC4)c3)CC2=O)cc1
InChIInChI=1S/C23H27NO4/c1-26-19-10-8-18(9-11-19)24-15-17(14-23(24)25)16-7-12-21(27-2)22(13-16)28-20-5-3-4-6-20/h7-13,17,20H,3-6,14-15H2,1-2H3
InChIKeyHWJQBOKKFWUWMJ-UHFFFAOYSA-N
MW381.47 g/mol
LogP4.55
Rot. Bonds6

About 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one

4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one (PubChem CID 10619838) has the molecular formula C23H27NO4 and a molecular weight of 381.47 g/mol. Its IUPAC name is 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one
PubChem CID10619838
Molecular FormulaC23H27NO4
Molecular Weight381.47 g/mol
Exact Mass381.19
IUPAC Name4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one
SMILESCOc1ccc(N2CC(c3ccc(OC)c(OC4CCCC4)c3)CC2=O)cc1
InChIInChI=1S/C23H27NO4/c1-26-19-10-8-18(9-11-19)24-15-17(14-23(24)25)16-7-12-21(27-2)22(13-16)28-20-5-3-4-6-20/h7-13,17,20H,3-6,14-15H2,1-2H3
InChIKeyHWJQBOKKFWUWMJ-UHFFFAOYSA-N
XLogP4.55
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.47
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(4R)-4-(3-cyclopentyloxy-4-methoxyphenyl)-1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-one
CID 10364767
4-[(4R)-4-(3-cyclopentyloxy-4-methoxyphenyl)-2-oxopyrrolidin-1-yl]benzamide
CID 10046158
(4R)-4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(3-methylphenyl)pyrrolidin-2-one
CID 10021760
(4S)-4-(3-cyclopentyloxy-4-methoxyphenyl)-1-methylpyrrolidin-2-one
CID 53237242
(4R)-4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(3-methylsulfinylphenyl)pyrrolidin-2-one
CID 15958398
3-[4-(3-cyclopentyloxy-4-methoxyphenyl)-2-oxopyrrolidin-1-yl]benzenecarboximidamide
CID 68831352
1-butyl-4-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidin-2-one
CID 23614663
(4R)-1-[3-(1-aminoethenyl)phenyl]-4-(3,4-dicyclopentyloxyphenyl)pyrrolidin-2-one
CID 89146208
4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(2-morpholin-4-ylethyl)pyrrolidin-2-one
CID 54134810
2-[4-(3-cyclopentyloxy-4-methoxyphenyl)-2-oxopyrrolidin-1-yl]acetyl chloride
CID 23614685
4-(3-cyclopentyloxy-4-methoxyphenyl)-1-[3-[2-(dimethylamino)ethoxy]-5-[(3-methoxyphenyl)methoxy]phenyl]pyrrolidin-2-one
CID 10603786
4-(3-cyclopentyloxy-4-methoxyphenyl)oxane-2,6-dione
CID 71601856

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one?
The IUPAC name of 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one (CID 10619838) is 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one.
What is the SMILES notation for 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one?
The canonical SMILES for 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one is COc1ccc(N2CC(c3ccc(OC)c(OC4CCCC4)c3)CC2=O)cc1.
What is the InChIKey of 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one?
The InChIKey is HWJQBOKKFWUWMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27NO4/c1-26-19-10-8-18(9-11-19)24-15-17(14-23(24)25)16-7-12-21(27-2)22(13-16)28-20-5-3-4-6-20/h7-13,17,20H,3-6,14-15H2,1-2H3.
What are the key properties of 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one?
4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one has a molecular weight of 381.47 g/mol, XLogP of 4.55, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one is sourced from PubChem (CID 10619838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).