4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one

C11H20N2O3 — CID 106183997

IUPAC4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one
SMILESCCOC1CC(NC2CNC(=O)C2)C1OC
InChIInChI=1S/C11H20N2O3/c1-3-16-9-5-8(11(9)15-2)13-7-4-10(14)12-6-7/h7-9,11,13H,3-6H2,1-2H3,(H,12,14)
InChIKeyXGSQOKBFHGSAMN-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.34
Rot. Bonds5

About 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one

4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one (PubChem CID 106183997) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one
PubChem CID106183997
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one
SMILESCCOC1CC(NC2CNC(=O)C2)C1OC
InChIInChI=1S/C11H20N2O3/c1-3-16-9-5-8(11(9)15-2)13-7-4-10(14)12-6-7/h7-9,11,13H,3-6H2,1-2H3,(H,12,14)
InChIKeyXGSQOKBFHGSAMN-UHFFFAOYSA-N
XLogP-0.34
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(3-ethoxy-2-methoxycyclobutyl)amino]cyclohexan-1-ol
CID 113364868
4-[(2,4,4-trimethylcyclopentyl)amino]pyrrolidin-2-one
CID 106184016
tert-butyl N-[2-[(3-ethoxy-2-methoxycyclobutyl)amino]cyclopropyl]carbamate
CID 107238131
(4R)-4-(2-methylpropylamino)pyrrolidin-2-one
CID 139457725
4-[(2-methylthiolan-3-yl)amino]pyrrolidin-2-one
CID 106182616
N-(5-oxopyrrolidin-3-yl)ethanesulfonamide
CID 105056076
4-[[2-(aminomethyl)cyclopentyl]amino]pyrrolidin-2-one
CID 106184314
1-(3-ethoxy-2-methoxycyclobutyl)-3-pyridin-4-ylurea
CID 75457928
4-(3-hydroxybutan-2-ylamino)pyrrolidin-2-one
CID 106189044
ethyl 3-hydroxy-4-[(5-oxopyrrolidin-3-yl)amino]butanoate
CID 106190615
(5R,6S)-6-tert-butyl-5-[(3-ethoxycyclobutyl)amino]piperidin-2-one
CID 136582015
2-N-(3-ethoxy-2-methoxycyclobutyl)-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 113364970

Frequently Asked Questions

What is the IUPAC name of 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one?
The IUPAC name of 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one (CID 106183997) is 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one.
What is the SMILES notation for 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one?
The canonical SMILES for 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one is CCOC1CC(NC2CNC(=O)C2)C1OC.
What is the InChIKey of 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one?
The InChIKey is XGSQOKBFHGSAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-3-16-9-5-8(11(9)15-2)13-7-4-10(14)12-6-7/h7-9,11,13H,3-6H2,1-2H3,(H,12,14).
What are the key properties of 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one?
4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one has a molecular weight of 228.29 g/mol, XLogP of -0.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-ethoxy-2-methoxycyclobutyl)amino]pyrrolidin-2-one is sourced from PubChem (CID 106183997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).