[2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone

C14H26N2O2 — CID 106828083

IUPAC[2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone
SMILESCNCC1CN(C(=O)C2(C)CCCCC2)CCO1
InChIInChI=1S/C14H26N2O2/c1-14(6-4-3-5-7-14)13(17)16-8-9-18-12(11-16)10-15-2/h12,15H,3-11H2,1-2H3
InChIKeyXYOHQMVFDNFWKH-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.40
Rot. Bonds3

About [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone

[2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone (PubChem CID 106828083) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone.

Molecular Properties

Compound Name[2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone
PubChem CID106828083
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name[2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone
SMILESCNCC1CN(C(=O)C2(C)CCCCC2)CCO1
InChIInChI=1S/C14H26N2O2/c1-14(6-4-3-5-7-14)13(17)16-8-9-18-12(11-16)10-15-2/h12,15H,3-11H2,1-2H3
InChIKeyXYOHQMVFDNFWKH-UHFFFAOYSA-N
XLogP1.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
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

(2R)-2-(methylaminomethyl)morpholine-4-carboxylic acid
CID 138694205
(2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone
CID 107180979
[2-(hydroxymethyl)morpholin-4-yl]-(3-methylpiperidin-3-yl)methanone;hydrochloride
CID 119945377
2-methyl-1-[(2S)-2-(methylaminomethyl)morpholin-4-yl]propan-1-one
CID 139553521
cyclopropyl-[(2S)-2-(methylaminomethyl)morpholin-4-yl]methanone
CID 166684105
(2-ethylmorpholin-4-yl)-(3-methylpyrrolidin-3-yl)methanone
CID 63138991
cyclopentyl 2-(methylaminomethyl)morpholine-4-carboxylate
CID 112738613
[(2S)-2-[(4-fluorophenyl)methyl]morpholin-4-yl]-(1-methylcyclopropyl)methanone
CID 95126263
2,2,3,3-tetrafluoro-1-[2-(methylaminomethyl)morpholin-4-yl]propan-1-one
CID 114032641
(1-aminocyclohexyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone;hydrochloride
CID 119322376
1-(2-ethylmorpholin-4-yl)-2-[1-(methylamino)cyclohexyl]ethanone
CID 65240974
[(3R)-3-hydroxypyrrolidin-1-yl]-(1-methylcycloheptyl)methanone
CID 110027381

Frequently Asked Questions

What is the IUPAC name of [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone?
The IUPAC name of [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone (CID 106828083) is [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone.
What is the SMILES notation for [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone?
The canonical SMILES for [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone is CNCC1CN(C(=O)C2(C)CCCCC2)CCO1.
What is the InChIKey of [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone?
The InChIKey is XYOHQMVFDNFWKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-14(6-4-3-5-7-14)13(17)16-8-9-18-12(11-16)10-15-2/h12,15H,3-11H2,1-2H3.
What are the key properties of [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone?
[2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone has a molecular weight of 254.37 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone is sourced from PubChem (CID 106828083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).