(4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one

C16H26N2O3 — CID 99591121

IUPAC(4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one
SMILESCC1(C)CN(C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)CCO1
InChIInChI=1S/C16H26N2O3/c1-16(2)11-17(7-8-21-16)15(20)12-9-14(19)18(10-12)13-5-3-4-6-13/h12-13H,3-11H2,1-2H3/t12-/m0/s1
InChIKeyRSPJXAZFNKABSY-LBPRGKRZSA-N
MW294.39 g/mol
LogP1.41
Rot. Bonds2

About (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one

(4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one (PubChem CID 99591121) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one
PubChem CID99591121
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name(4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one
SMILESCC1(C)CN(C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)CCO1
InChIInChI=1S/C16H26N2O3/c1-16(2)11-17(7-8-21-16)15(20)12-9-14(19)18(10-12)13-5-3-4-6-13/h12-13H,3-11H2,1-2H3/t12-/m0/s1
InChIKeyRSPJXAZFNKABSY-LBPRGKRZSA-N
XLogP1.41
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-(aminomethyl)-3-methylpyrrolidine-1-carbonyl]-1-cyclopentylpyrrolidin-2-one;hydrochloride
CID 120808570
(4S)-1-cyclopentyl-4-(4-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 9364634
(4R)-1-cyclopentyl-4-(4-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 9364632
1-cyclopropyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one
CID 60656167
1-cyclohexyl-4-(3,5-dimethylpiperidine-1-carbonyl)pyrrolidin-2-one
CID 17257425
1-cyclohexyl-4-(4-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 4251317
1-cyclopentyl-4-[(3S,4R)-3,4-dihydroxypyrrolidine-1-carbonyl]pyrrolidin-2-one
CID 79403206
1-cyclopentyl-4-(3-hydroxyazetidine-1-carbonyl)pyrrolidin-2-one
CID 55179169
4-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)piperazine-2,6-dione
CID 66085474
2-[(2S)-4-[(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carbonyl]morpholin-2-yl]acetic acid
CID 129465906
(4S)-1-cyclopentyl-4-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 9363484
8-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 56809745

Frequently Asked Questions

What is the IUPAC name of (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one?
The IUPAC name of (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one (CID 99591121) is (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one.
What is the SMILES notation for (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one?
The canonical SMILES for (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one is CC1(C)CN(C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)CCO1.
What is the InChIKey of (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one?
The InChIKey is RSPJXAZFNKABSY-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-16(2)11-17(7-8-21-16)15(20)12-9-14(19)18(10-12)13-5-3-4-6-13/h12-13H,3-11H2,1-2H3/t12-/m0/s1.
What are the key properties of (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one?
(4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one has a molecular weight of 294.39 g/mol, XLogP of 1.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-1-cyclopentyl-4-(2,2-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one is sourced from PubChem (CID 99591121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).