2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine

C13H28N4O — CID 79165951

IUPAC2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine
SMILESCCN1CCOC(CN2CCN(CCN)CC2)C1
InChIInChI=1S/C13H28N4O/c1-2-15-9-10-18-13(11-15)12-17-7-5-16(4-3-14)6-8-17/h13H,2-12,14H2,1H3
InChIKeyQMDAUAANABEWFP-UHFFFAOYSA-N
MW256.39 g/mol
LogP-0.72
Rot. Bonds5

About 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine

2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine (PubChem CID 79165951) has the molecular formula C13H28N4O and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine
PubChem CID79165951
Molecular FormulaC13H28N4O
Molecular Weight256.39 g/mol
Exact Mass256.23
IUPAC Name2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine
SMILESCCN1CCOC(CN2CCN(CCN)CC2)C1
InChIInChI=1S/C13H28N4O/c1-2-15-9-10-18-13(11-15)12-17-7-5-16(4-3-14)6-8-17/h13H,2-12,14H2,1H3
InChIKeyQMDAUAANABEWFP-UHFFFAOYSA-N
XLogP-0.72
TPSA44.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 5-0.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[1-[(4-ethylmorpholin-2-yl)methyl]-4-methylpiperidin-4-yl]methanamine
CID 107160487
2-[4-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-diazepan-1-yl]ethanamine
CID 64533682
2,4-diethylmorpholine
CID 58988021
1-[(4-ethylmorpholin-2-yl)methyl]piperidine-4-carbothioamide
CID 79172211
(2S)-4-ethyl-2-[[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]methyl]morpholine
CID 95766645
1-[(4-ethylmorpholin-2-yl)methyl]piperidine-4-carbaldehyde
CID 79182828
2-[(3-chloropyrrolidin-1-yl)methyl]-4-ethylmorpholine
CID 79182491
2-[(4-ethylmorpholin-2-yl)methylsulfanyl]ethanamine
CID 79171551
3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine
CID 79182409
3-ethyl-1-[(4-ethylmorpholin-2-yl)methyl]piperidin-4-amine
CID 81460895
1-[(4-ethylmorpholin-2-yl)methyl]piperidine-4-carboximidamide
CID 79171844
2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]butanenitrile
CID 79165345

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine?
The IUPAC name of 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine (CID 79165951) is 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine.
What is the SMILES notation for 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine?
The canonical SMILES for 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine is CCN1CCOC(CN2CCN(CCN)CC2)C1.
What is the InChIKey of 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine?
The InChIKey is QMDAUAANABEWFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4O/c1-2-15-9-10-18-13(11-15)12-17-7-5-16(4-3-14)6-8-17/h13H,2-12,14H2,1H3.
What are the key properties of 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine?
2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine has a molecular weight of 256.39 g/mol, XLogP of -0.72, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine is sourced from PubChem (CID 79165951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).