(3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone

C13H24N2O2 — CID 104689740

IUPAC(3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone
SMILESCCC1CCCCCN1C(=O)C1(N)CCOC1
InChIInChI=1S/C13H24N2O2/c1-2-11-6-4-3-5-8-15(11)12(16)13(14)7-9-17-10-13/h11H,2-10,14H2,1H3
InChIKeyNIMNTAQDPRSLDZ-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.29
Rot. Bonds2

About (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone

(3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone (PubChem CID 104689740) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone.

Molecular Properties

Compound Name(3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone
PubChem CID104689740
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name(3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone
SMILESCCC1CCCCCN1C(=O)C1(N)CCOC1
InChIInChI=1S/C13H24N2O2/c1-2-11-6-4-3-5-8-15(11)12(16)13(14)7-9-17-10-13/h11H,2-10,14H2,1H3
InChIKeyNIMNTAQDPRSLDZ-UHFFFAOYSA-N
XLogP1.29
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone with MolForge

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

Launch Full Analysis

Related Compounds

3-[1-(3-aminooxolane-3-carbonyl)piperidin-2-yl]propanoic acid
CID 64891608
N-[2-[1-(3-aminooxolane-3-carbonyl)piperidin-2-yl]ethyl]methanesulfonamide
CID 64891761
(1-amino-3-methylcyclohexyl)-(2-ethylazepan-1-yl)methanone
CID 104689695
[1-(2-ethylpiperidine-1-carbonyl)cyclopropyl]-(2-ethylpiperidin-1-yl)methanone
CID 108980012
(4-aminooxan-4-yl)-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 107218110
(4-aminooxan-4-yl)-(3-ethylmorpholin-4-yl)methanone
CID 115293761
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(3-aminooxolan-3-yl)methanone
CID 82746951
2-(1-aminocyclohexyl)-1-(2-ethylazepan-1-yl)ethanone
CID 104689647
1-[(2R)-2-ethylpiperidin-1-yl]propan-1-one
CID 40538705
1-(2-ethylazepan-1-yl)ethanone
CID 115642380
1-(2-ethylazepan-1-yl)-3-methoxypropan-1-one
CID 167776443
1-(2-ethylpiperidin-1-yl)-2-(oxan-3-yl)ethanone
CID 110855934

Frequently Asked Questions

What is the IUPAC name of (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone?
The IUPAC name of (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone (CID 104689740) is (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone.
What is the SMILES notation for (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone?
The canonical SMILES for (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone is CCC1CCCCCN1C(=O)C1(N)CCOC1.
What is the InChIKey of (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone?
The InChIKey is NIMNTAQDPRSLDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-2-11-6-4-3-5-8-15(11)12(16)13(14)7-9-17-10-13/h11H,2-10,14H2,1H3.
What are the key properties of (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone?
(3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminooxolan-3-yl)-(2-ethylazepan-1-yl)methanone is sourced from PubChem (CID 104689740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).