3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one

C14H24N2O2 — CID 114136071

IUPAC3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one
SMILESO=C1C(NC2CC2)CCN1CCC1CCCCO1
InChIInChI=1S/C14H24N2O2/c17-14-13(15-11-4-5-11)7-9-16(14)8-6-12-3-1-2-10-18-12/h11-13,15H,1-10H2
InChIKeySSELEVPNDLSWMO-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.30
Rot. Bonds5

About 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one

3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one (PubChem CID 114136071) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one
PubChem CID114136071
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one
SMILESO=C1C(NC2CC2)CCN1CCC1CCCCO1
InChIInChI=1S/C14H24N2O2/c17-14-13(15-11-4-5-11)7-9-16(14)8-6-12-3-1-2-10-18-12/h11-13,15H,1-10H2
InChIKeySSELEVPNDLSWMO-UHFFFAOYSA-N
XLogP1.30
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropylamino)-1-[2-(1-methylpiperidin-4-yl)ethyl]piperidin-2-one
CID 114516757
1-[2-(oxolan-2-yl)ethyl]piperidine-2,4-dione
CID 79516815
1-[2-(5-chlorothiophen-2-yl)ethyl]-3-(cyclopropylamino)pyrrolidin-2-one
CID 106039908
1-[2-(oxan-2-yl)ethyl]-1,4-diazepane-2,5-dione
CID 106003016
3-(cyclopropylamino)-1-[2-(trifluoromethylsulfanyl)ethyl]pyrrolidin-2-one
CID 106432540
N-[3-[3-(cyclopropylamino)-2-oxopyrrolidin-1-yl]propyl]methanesulfonamide
CID 106338480
3-(cyclopropylamino)-1-(4-hydroxypentyl)pyrrolidin-2-one
CID 106137685
3-(cyclopropylamino)-1-[3-(2-hydroxyethoxy)propyl]piperidin-2-one
CID 106305737
3,3-dimethyl-1-[2-(oxan-2-yl)ethyl]piperazine-2,5-dione
CID 106002969
3-(methylamino)-1-(oxolan-2-ylmethyl)azepan-2-one
CID 22984909
N-cyclopropyl-3-[3-(cyclopropylamino)-2-oxopiperidin-1-yl]propanamide
CID 79400868
N-[2-(oxan-2-yl)ethyl]cyclopropanamine
CID 62548830

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one?
The IUPAC name of 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one (CID 114136071) is 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one.
What is the SMILES notation for 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one?
The canonical SMILES for 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one is O=C1C(NC2CC2)CCN1CCC1CCCCO1.
What is the InChIKey of 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one?
The InChIKey is SSELEVPNDLSWMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c17-14-13(15-11-4-5-11)7-9-16(14)8-6-12-3-1-2-10-18-12/h11-13,15H,1-10H2.
What are the key properties of 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one?
3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one has a molecular weight of 252.36 g/mol, XLogP of 1.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-1-[2-(oxan-2-yl)ethyl]pyrrolidin-2-one is sourced from PubChem (CID 114136071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).