2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine

C15H31N3O — CID 63871997

IUPAC2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine
SMILESCC(C)CN1CCOC(CN2CC(C)NC(C)C2)C1
InChIInChI=1S/C15H31N3O/c1-12(2)7-17-5-6-19-15(10-17)11-18-8-13(3)16-14(4)9-18/h12-16H,5-11H2,1-4H3
InChIKeyYYOFNBXUEOQVGB-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.03
Rot. Bonds4

About 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine

2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine (PubChem CID 63871997) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine.

Molecular Properties

Compound Name2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine
PubChem CID63871997
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine
SMILESCC(C)CN1CCOC(CN2CC(C)NC(C)C2)C1
InChIInChI=1S/C15H31N3O/c1-12(2)7-17-5-6-19-15(10-17)11-18-8-13(3)16-14(4)9-18/h12-16H,5-11H2,1-4H3
InChIKeyYYOFNBXUEOQVGB-UHFFFAOYSA-N
XLogP1.03
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine
CID 114398613
5-methyl-1-[[4-(2-methylpropyl)morpholin-2-yl]methyl]piperidin-3-amine
CID 79992878
(2S)-2-(3-methylbutyl)-4-(2-methylpropyl)morpholine
CID 161175783
1-[1-[[4-(2-methylpropyl)morpholin-2-yl]methyl]piperidin-4-yl]ethanamine
CID 63595361
N,N-dimethyl-1-[4-(2-methylpropyl)morpholin-2-yl]methanamine
CID 123749859
ethane;2-methyl-4-(2-methylpropyl)morpholine
CID 156652353
[6,6-dimethyl-4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanol
CID 114779619
4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine
CID 104975908
[4-methyl-1-[[4-(2-methylpropyl)morpholin-2-yl]methyl]piperazin-2-yl]methanamine
CID 80506904
2-(azetidin-3-ylmethylsulfanylmethyl)-4-(2-methylpropyl)morpholine
CID 66290127
2-[[4-(2-methylpropyl)morpholin-2-yl]methylsulfanyl]propan-1-amine
CID 66218624
[4-(2-methylpropyl)-1,4-oxazepan-2-yl]methanamine
CID 131115606

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine?
The IUPAC name of 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine (CID 63871997) is 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine.
What is the SMILES notation for 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine?
The canonical SMILES for 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine is CC(C)CN1CCOC(CN2CC(C)NC(C)C2)C1.
What is the InChIKey of 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine?
The InChIKey is YYOFNBXUEOQVGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-12(2)7-17-5-6-19-15(10-17)11-18-8-13(3)16-14(4)9-18/h12-16H,5-11H2,1-4H3.
What are the key properties of 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine?
2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine has a molecular weight of 269.43 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethylpiperazin-1-yl)methyl]-4-(2-methylpropyl)morpholine is sourced from PubChem (CID 63871997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).