[4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone

C13H24N2O2 — CID 66266661

IUPAC[4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone
SMILESCNC1COCC1C(=O)N1CCCCCC1C
InChIInChI=1S/C13H24N2O2/c1-10-6-4-3-5-7-15(10)13(16)11-8-17-9-12(11)14-2/h10-12,14H,3-9H2,1-2H3
InChIKeyFXMPCJCBQBRKFD-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.01
Rot. Bonds2

About [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone

[4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone (PubChem CID 66266661) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone.

Molecular Properties

Compound Name[4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone
PubChem CID66266661
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name[4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone
SMILESCNC1COCC1C(=O)N1CCCCCC1C
InChIInChI=1S/C13H24N2O2/c1-10-6-4-3-5-7-15(10)13(16)11-8-17-9-12(11)14-2/h10-12,14H,3-9H2,1-2H3
InChIKeyFXMPCJCBQBRKFD-UHFFFAOYSA-N
XLogP1.01
TPSA41.57 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 ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(methylamino)oxolane-3-carbonyl]pyrrolidine-2-carboxylic acid
CID 66267016
4-[(2-methylazepane-1-carbonyl)amino]oxolane-3-carboxylic acid
CID 66239382
(4-methoxy-2-methylpiperidin-1-yl)-[4-(methylamino)oxolan-3-yl]methanone
CID 114220982
methyl 1-[4-(methylamino)oxolane-3-carbonyl]pyrrolidine-2-carboxylate
CID 66266602
[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-[4-(methylamino)oxolan-3-yl]methanone
CID 66265069
(4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone
CID 66236454
[4-(methylamino)oxolan-3-yl]-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
CID 66265073
(4-hydroxypiperidin-1-yl)-[4-(methylamino)oxolan-3-yl]methanone
CID 66267148
4-(methylamino)-N-piperidin-1-yloxolane-3-carboxamide
CID 83021088
2-(2-methylpiperidine-1-carbonyl)cyclobutane-1-carboxylic acid
CID 120974339
(3-hydroxypiperidin-1-yl)-[4-(methylamino)oxolan-3-yl]methanone
CID 66267351
[4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone
CID 83052187

Frequently Asked Questions

What is the IUPAC name of [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone?
The IUPAC name of [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone (CID 66266661) is [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone.
What is the SMILES notation for [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone?
The canonical SMILES for [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone is CNC1COCC1C(=O)N1CCCCCC1C.
What is the InChIKey of [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone?
The InChIKey is FXMPCJCBQBRKFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10-6-4-3-5-7-15(10)13(16)11-8-17-9-12(11)14-2/h10-12,14H,3-9H2,1-2H3.
What are the key properties of [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone?
[4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone is sourced from PubChem (CID 66266661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).