4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine

C19H31N3O2 — CID 51000970

IUPAC4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine
SMILESCOCCN1CCN(C(CN2CCOCC2)c2ccccc2)CC1
InChIInChI=1S/C19H31N3O2/c1-23-14-11-20-7-9-22(10-8-20)19(18-5-3-2-4-6-18)17-21-12-15-24-16-13-21/h2-6,19H,7-17H2,1H3
InChIKeyOBXJCQAKMKHNMU-UHFFFAOYSA-N
MW333.48 g/mol
LogP1.32
Rot. Bonds7

About 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine

4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine (PubChem CID 51000970) has the molecular formula C19H31N3O2 and a molecular weight of 333.48 g/mol. Its IUPAC name is 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine.

Molecular Properties

Compound Name4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine
PubChem CID51000970
Molecular FormulaC19H31N3O2
Molecular Weight333.48 g/mol
Exact Mass333.24
IUPAC Name4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine
SMILESCOCCN1CCN(C(CN2CCOCC2)c2ccccc2)CC1
InChIInChI=1S/C19H31N3O2/c1-23-14-11-20-7-9-22(10-8-20)19(18-5-3-2-4-6-18)17-21-12-15-24-16-13-21/h2-6,19H,7-17H2,1H3
InChIKeyOBXJCQAKMKHNMU-UHFFFAOYSA-N
XLogP1.32
TPSA28.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 85812
Decloxizine
CID 71135
Ethyl 2-(4-benzylpiperazin-1-yl)acetate
CID 5060109
Jnj-10181457
CID 9944610
2,6-Dimethyl-4-(1-(4-methylbenzyl)piperidin-4-yl)morpholine hydrochloride
CID 24761181
[(2R)-1,4-dibenzylpiperazin-2-yl]methanol
CID 9994741
Dimorpholinophenylmethane
CID 80899
4-Benzylmorpholine
CID 249546
2-(4-Fluorophenyl)-2-(morpholin-4-yl)ethan-1-amine
CID 4352885
4-Benzylmorpholine hydrochloride
CID 2849468
4-[[4-(4-Piperidin-1-ylbut-1-ynyl)phenyl]methyl]morpholine
CID 10193234
4-[4-[4-(Piperidin-1-ylmethyl)phenyl]but-3-ynyl]morpholine
CID 10236617

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine?
The IUPAC name of 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine (CID 51000970) is 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine.
What is the SMILES notation for 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine?
The canonical SMILES for 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine is COCCN1CCN(C(CN2CCOCC2)c2ccccc2)CC1.
What is the InChIKey of 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine?
The InChIKey is OBXJCQAKMKHNMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O2/c1-23-14-11-20-7-9-22(10-8-20)19(18-5-3-2-4-6-18)17-21-12-15-24-16-13-21/h2-6,19H,7-17H2,1H3.
What are the key properties of 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine?
4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine has a molecular weight of 333.48 g/mol, XLogP of 1.32, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-2-phenylethyl]morpholine is sourced from PubChem (CID 51000970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).