(2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone

C14H26N2O2 — CID 107180979

IUPAC(2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone
SMILESCNCC1CN(C(=O)C2CCCC2(C)C)CCO1
InChIInChI=1S/C14H26N2O2/c1-14(2)6-4-5-12(14)13(17)16-7-8-18-11(10-16)9-15-3/h11-12,15H,4-10H2,1-3H3
InChIKeyKERRIZNTAGBPJE-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.26
Rot. Bonds3

About (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone

(2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone (PubChem CID 107180979) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone
PubChem CID107180979
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name(2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone
SMILESCNCC1CN(C(=O)C2CCCC2(C)C)CCO1
InChIInChI=1S/C14H26N2O2/c1-14(2)6-4-5-12(14)13(17)16-7-8-18-11(10-16)9-15-3/h11-12,15H,4-10H2,1-3H3
InChIKeyKERRIZNTAGBPJE-UHFFFAOYSA-N
XLogP1.26
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 ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropyl-[(2S)-2-(methylaminomethyl)morpholin-4-yl]methanone
CID 166684105
[2-(methylaminomethyl)morpholin-4-yl]-(1-methylcyclohexyl)methanone
CID 106828083
(2R)-2-(methylaminomethyl)morpholine-4-carboxylic acid
CID 138694205
cyclopentyl 2-(methylaminomethyl)morpholine-4-carboxylate
CID 112738613
2-methyl-1-[(2S)-2-(methylaminomethyl)morpholin-4-yl]propan-1-one
CID 139553521
[2-(chloromethyl)morpholin-4-yl]-(2,2-dimethylcyclopropyl)methanone
CID 107003221
[3-(aminomethyl)pyrrolidin-1-yl]-(2,2-dimethylcyclopentyl)methanone
CID 107180661
(2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone
CID 104917952
2,2,3,3-tetrafluoro-1-[2-(methylaminomethyl)morpholin-4-yl]propan-1-one
CID 114032641
(4-bromopiperidin-1-yl)-(2,2-dimethylcyclopentyl)methanone
CID 107183919
[6-(chloromethyl)-2,2-dimethylmorpholin-4-yl]-(2,2-dimethylcyclohexyl)methanone
CID 107184448
(2,2-dimethylcyclopentyl)-(3-hydroxy-3-methylpyrrolidin-1-yl)methanone
CID 104919981

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone?
The IUPAC name of (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone (CID 107180979) is (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone.
What is the SMILES notation for (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone?
The canonical SMILES for (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone is CNCC1CN(C(=O)C2CCCC2(C)C)CCO1.
What is the InChIKey of (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone?
The InChIKey is KERRIZNTAGBPJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-14(2)6-4-5-12(14)13(17)16-7-8-18-11(10-16)9-15-3/h11-12,15H,4-10H2,1-3H3.
What are the key properties of (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone?
(2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone has a molecular weight of 254.37 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylcyclopentyl)-[2-(methylaminomethyl)morpholin-4-yl]methanone is sourced from PubChem (CID 107180979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).