[4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone

C15H27NO2 — CID 116588105

IUPAC[4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone
SMILESCCNC1COCC1C(=O)C1CCC(CC)CC1
InChIInChI=1S/C15H27NO2/c1-3-11-5-7-12(8-6-11)15(17)13-9-18-10-14(13)16-4-2/h11-14,16H,3-10H2,1-2H3
InChIKeyGAQGKOLESPFQLO-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.40
Rot. Bonds5

About [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone

[4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone (PubChem CID 116588105) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone.

Molecular Properties

Compound Name[4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone
PubChem CID116588105
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name[4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone
SMILESCCNC1COCC1C(=O)C1CCC(CC)CC1
InChIInChI=1S/C15H27NO2/c1-3-11-5-7-12(8-6-11)15(17)13-9-18-10-14(13)16-4-2/h11-14,16H,3-10H2,1-2H3
InChIKeyGAQGKOLESPFQLO-UHFFFAOYSA-N
XLogP2.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone?
The IUPAC name of [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone (CID 116588105) is [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone.
What is the SMILES notation for [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone?
The canonical SMILES for [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone is CCNC1COCC1C(=O)C1CCC(CC)CC1.
What is the InChIKey of [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone?
The InChIKey is GAQGKOLESPFQLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-3-11-5-7-12(8-6-11)15(17)13-9-18-10-14(13)16-4-2/h11-14,16H,3-10H2,1-2H3.
What are the key properties of [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone?
[4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone has a molecular weight of 253.39 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)oxolan-3-yl]-(4-ethylcyclohexyl)methanone is sourced from PubChem (CID 116588105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).