N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine

C13H28N4O — CID 79182703

IUPACN-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine
SMILESCN1CCOC(CN(C)CCN2CCNCC2)C1
InChIInChI=1S/C13H28N4O/c1-15(7-8-17-5-3-14-4-6-17)11-13-12-16(2)9-10-18-13/h13-14H,3-12H2,1-2H3
InChIKeyANMGASJCYFPTPV-UHFFFAOYSA-N
MW256.39 g/mol
LogP-0.85
Rot. Bonds5

About N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine

N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine (PubChem CID 79182703) has the molecular formula C13H28N4O and a molecular weight of 256.39 g/mol. Its IUPAC name is N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine.

Molecular Properties

Compound NameN-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine
PubChem CID79182703
Molecular FormulaC13H28N4O
Molecular Weight256.39 g/mol
Exact Mass256.23
IUPAC NameN-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine
SMILESCN1CCOC(CN(C)CCN2CCNCC2)C1
InChIInChI=1S/C13H28N4O/c1-15(7-8-17-5-3-14-4-6-17)11-13-12-16(2)9-10-18-13/h13-14H,3-12H2,1-2H3
InChIKeyANMGASJCYFPTPV-UHFFFAOYSA-N
XLogP-0.85
TPSA30.98 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 ≤ 5-0.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-2-piperazin-1-ylethanamine
CID 63236887
ethane;4-methyl-2-(piperazin-1-ylmethyl)morpholine
CID 144702613
N-(cyclobutylmethyl)-N-methyl-2-piperazin-1-ylethanamine
CID 62860620
5-chloro-N-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-1-amine
CID 107205092
2-(1,4-diazepan-1-yl)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]ethanamine
CID 63274337
N',2-dimethyl-N'-[(4-methylmorpholin-2-yl)methyl]propane-1,3-diamine
CID 79171481
N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine
CID 115230585
N'-(2-aminoethyl)-N'-[(4-methylmorpholin-2-yl)methyl]ethane-1,2-diamine
CID 79171859
N-[(4-ethylmorpholin-2-yl)methyl]-N-methylpropan-1-amine
CID 142615879
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-2-morpholin-2-ylethanamine
CID 66426867
N-ethyl-N-(oxolan-2-ylmethyl)-2-piperazin-1-ylethanamine
CID 54983931
4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol
CID 113269056

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine?
The IUPAC name of N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine (CID 79182703) is N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine.
What is the SMILES notation for N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine?
The canonical SMILES for N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine is CN1CCOC(CN(C)CCN2CCNCC2)C1.
What is the InChIKey of N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine?
The InChIKey is ANMGASJCYFPTPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4O/c1-15(7-8-17-5-3-14-4-6-17)11-13-12-16(2)9-10-18-13/h13-14H,3-12H2,1-2H3.
What are the key properties of N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine?
N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine has a molecular weight of 256.39 g/mol, XLogP of -0.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(4-methylmorpholin-2-yl)methyl]-2-piperazin-1-ylethanamine is sourced from PubChem (CID 79182703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).