(2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone

C14H26N2O2 — CID 66255960

IUPAC(2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
SMILESCCCNC1COCC1C(=O)N1CCCC1CC
InChIInChI=1S/C14H26N2O2/c1-3-7-15-13-10-18-9-12(13)14(17)16-8-5-6-11(16)4-2/h11-13,15H,3-10H2,1-2H3
InChIKeyDSGXOYIZUHHUKX-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.40
Rot. Bonds5

About (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone

(2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone (PubChem CID 66255960) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone.

Molecular Properties

Compound Name(2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
PubChem CID66255960
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name(2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
SMILESCCCNC1COCC1C(=O)N1CCCC1CC
InChIInChI=1S/C14H26N2O2/c1-3-7-15-13-10-18-9-12(13)14(17)16-8-5-6-11(16)4-2/h11-13,15H,3-10H2,1-2H3
InChIKeyDSGXOYIZUHHUKX-UHFFFAOYSA-N
XLogP1.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone
CID 83052187
1-[4-(propylamino)oxolane-3-carbonyl]pyrrolidine-2-carboxylic acid
CID 66256153
[4-(propylamino)oxolan-3-yl]-(2,3,5-trimethylpiperidin-1-yl)methanone
CID 114593120
(3-ethylmorpholin-4-yl)-[4-(methylamino)oxolan-3-yl]methanone
CID 66266572
[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-[4-(methylamino)oxolan-3-yl]methanone
CID 66265069
(4-methyl-1,4-diazepan-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
CID 66256881
[3-(dimethylamino)pyrrolidin-1-yl]-[4-(propylamino)oxolan-3-yl]methanone
CID 66256744
cyclopropyl-[4-(propylamino)oxolan-3-yl]methanone
CID 116587886
(4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
CID 66256555
(2-ethylpyrrolidin-1-yl)-[(1S,2S)-2-methylcyclopropyl]methanone
CID 130685547
(4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
CID 66256554
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-[4-(propylamino)oxolan-3-yl]methanone
CID 114797463

Frequently Asked Questions

What is the IUPAC name of (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
The IUPAC name of (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone (CID 66255960) is (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone.
What is the SMILES notation for (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
The canonical SMILES for (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone is CCCNC1COCC1C(=O)N1CCCC1CC.
What is the InChIKey of (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
The InChIKey is DSGXOYIZUHHUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-3-7-15-13-10-18-9-12(13)14(17)16-8-5-6-11(16)4-2/h11-13,15H,3-10H2,1-2H3.
What are the key properties of (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
(2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone has a molecular weight of 254.37 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone is sourced from PubChem (CID 66255960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).