4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine

C12H25N3O — CID 104975908

IUPAC4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine
SMILESCCN1CCOC(CN2CCN[C@H](C)C2)C1
InChIInChI=1S/C12H25N3O/c1-3-14-6-7-16-12(9-14)10-15-5-4-13-11(2)8-15/h11-13H,3-10H2,1-2H3/t11-,12?/m1/s1
InChIKeyJLITVODGROJZLH-JHJMLUEUSA-N
MW227.35 g/mol
LogP0.00
Rot. Bonds3

About 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine

4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine (PubChem CID 104975908) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine.

Molecular Properties

Compound Name4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine
PubChem CID104975908
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine
SMILESCCN1CCOC(CN2CCN[C@H](C)C2)C1
InChIInChI=1S/C12H25N3O/c1-3-14-6-7-16-12(9-14)10-15-5-4-13-11(2)8-15/h11-13H,3-10H2,1-2H3/t11-,12?/m1/s1
InChIKeyJLITVODGROJZLH-JHJMLUEUSA-N
XLogP0.00
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-2-[(6-ethyl-3-methyl-1,5-diazocan-1-yl)methyl]morpholine
CID 114401113
3-methyl-1-(oxolan-2-ylmethyl)-1,4-diazepane
CID 64858824
2-[(3-chloropyrrolidin-1-yl)methyl]-4-ethylmorpholine
CID 79182491
2,4-diethylmorpholine
CID 58988021
2-(1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-ylmethyl)-4-ethylmorpholine
CID 102682618
2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine
CID 79165951
3-ethyl-1-[(4-ethylmorpholin-2-yl)methyl]piperidin-4-amine
CID 81460895
2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine
CID 63871997
4-ethyl-2-[(3-ethyl-3-methyl-1,4-diazepan-1-yl)methyl]morpholine
CID 114401357
4-ethyl-2-propylmorpholine
CID 127673597
3-[(3-methylpiperazin-1-yl)methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazine
CID 79072001
N-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]piperidin-3-amine
CID 114401290

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine?
The IUPAC name of 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine (CID 104975908) is 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine.
What is the SMILES notation for 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine?
The canonical SMILES for 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine is CCN1CCOC(CN2CCN[C@H](C)C2)C1.
What is the InChIKey of 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine?
The InChIKey is JLITVODGROJZLH-JHJMLUEUSA-N. The full InChI is InChI=1S/C12H25N3O/c1-3-14-6-7-16-12(9-14)10-15-5-4-13-11(2)8-15/h11-13H,3-10H2,1-2H3/t11-,12?/m1/s1.
What are the key properties of 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine?
4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine has a molecular weight of 227.35 g/mol, XLogP of 0.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine is sourced from PubChem (CID 104975908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).