(5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride

C12H23ClN2O2 — CID 119682273

IUPAC(5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride
SMILESCCC1COC(C)CN1C(=O)C1CCNC1.Cl
InChIInChI=1S/C12H22N2O2.ClH/c1-3-11-8-16-9(2)7-14(11)12(15)10-4-5-13-6-10;/h9-11,13H,3-8H2,1-2H3;1H
InChIKeyPFAITKPNBMLTJM-UHFFFAOYSA-N
MW262.78 g/mol
LogP1.04
Rot. Bonds2

About (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride

(5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride (PubChem CID 119682273) has the molecular formula C12H23ClN2O2 and a molecular weight of 262.78 g/mol. Its IUPAC name is (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride.

Molecular Properties

Compound Name(5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride
PubChem CID119682273
Molecular FormulaC12H23ClN2O2
Molecular Weight262.78 g/mol
Exact Mass262.14
IUPAC Name(5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride
SMILESCCC1COC(C)CN1C(=O)C1CCNC1.Cl
InChIInChI=1S/C12H22N2O2.ClH/c1-3-11-8-16-9(2)7-14(11)12(15)10-4-5-13-6-10;/h9-11,13H,3-8H2,1-2H3;1H
InChIKeyPFAITKPNBMLTJM-UHFFFAOYSA-N
XLogP1.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.78
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropyl-(5-ethyl-2-methylmorpholin-4-yl)methanone
CID 60645279
(5-ethyl-2-methylmorpholin-4-yl)-piperazin-2-ylmethanone
CID 63104526
(2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride
CID 119292459
(5-ethyl-2-methylmorpholin-4-yl)-(4-methylpyrrolidin-3-yl)methanone
CID 63714753
(5-ethyl-2-methylmorpholin-4-yl)-(4-methylpiperidin-2-yl)methanone
CID 114422854
(5-ethyl-2-methylmorpholin-4-yl)-(4-ethylpiperidin-4-yl)methanone
CID 63128072
(2,6-dimethylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride
CID 119669803
(5-ethyl-2-methylmorpholin-4-yl)-piperidin-1-ylmethanone
CID 113222014
5-ethyl-2-methyl-4-(pyrrolidin-3-ylmethyl)morpholine
CID 62371779
(5-ethyl-2-methylmorpholin-4-yl)-(4-methoxypyrrolidin-2-yl)methanone
CID 61214758
[(2S,5R)-4-(cyclopropanecarbonyl)-2,5-diethylpiperazin-1-yl]-cyclopropylmethanone
CID 95774523
3-amino-1-(5-ethyl-2-methylmorpholin-4-yl)butan-1-one;hydrochloride
CID 119682269

Frequently Asked Questions

What is the IUPAC name of (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride?
The IUPAC name of (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride (CID 119682273) is (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride.
What is the SMILES notation for (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride?
The canonical SMILES for (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride is CCC1COC(C)CN1C(=O)C1CCNC1.Cl.
What is the InChIKey of (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride?
The InChIKey is PFAITKPNBMLTJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2.ClH/c1-3-11-8-16-9(2)7-14(11)12(15)10-4-5-13-6-10;/h9-11,13H,3-8H2,1-2H3;1H.
What are the key properties of (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride?
(5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride has a molecular weight of 262.78 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride is sourced from PubChem (CID 119682273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).