methyl-methylidene-(morpholin-4-ylmethyl)azanium

C7H15N2O+ — CID 91209028

IUPACmethyl-methylidene-(morpholin-4-ylmethyl)azanium
SMILESC=[N+](C)CN1CCOCC1
InChIInChI=1S/C7H15N2O/c1-8(2)7-9-3-5-10-6-4-9/h1,3-7H2,2H3/q+1
InChIKeyUKTLGWJCLTYMHZ-UHFFFAOYSA-N
MW143.21 g/mol
LogP-0.38
Rot. Bonds2

About methyl-methylidene-(morpholin-4-ylmethyl)azanium

methyl-methylidene-(morpholin-4-ylmethyl)azanium (PubChem CID 91209028) has the molecular formula C7H15N2O+ and a molecular weight of 143.21 g/mol. Its IUPAC name is methyl-methylidene-(morpholin-4-ylmethyl)azanium.

Molecular Properties

Compound Namemethyl-methylidene-(morpholin-4-ylmethyl)azanium
PubChem CID91209028
Molecular FormulaC7H15N2O+
Molecular Weight143.21 g/mol
Exact Mass143.12
IUPAC Namemethyl-methylidene-(morpholin-4-ylmethyl)azanium
SMILESC=[N+](C)CN1CCOCC1
InChIInChI=1S/C7H15N2O/c1-8(2)7-9-3-5-10-6-4-9/h1,3-7H2,2H3/q+1
InChIKeyUKTLGWJCLTYMHZ-UHFFFAOYSA-N
XLogP-0.38
TPSA15.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 5-0.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

4-(morpholin-4-ylmethyl)morpholine
CID 21839
4-ethylmorpholine;hydron
CID 174383624
astatane;4-ethylmorpholine
CID 174883073
4-[2-(4-methylpiperazin-1-yl)ethyl]morpholine
CID 20719664
ethane;N-methyl-2-morpholin-4-ylacetamide
CID 143296562
4-[(4-methylpiperidin-1-yl)methyl]morpholine
CID 155208667
16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71337150
ethane;4-propylmorpholine
CID 143004992
4-propylmorpholine;hydrobromide
CID 70540609
4-(chloromethyl)morpholine;hydrate
CID 175868958
4-(2-ethylperoxyethyl)morpholine
CID 18738549
4-[(2-methylcyclobutyl)methyl]morpholine
CID 67036054

Frequently Asked Questions

What is the IUPAC name of methyl-methylidene-(morpholin-4-ylmethyl)azanium?
The IUPAC name of methyl-methylidene-(morpholin-4-ylmethyl)azanium (CID 91209028) is methyl-methylidene-(morpholin-4-ylmethyl)azanium.
What is the SMILES notation for methyl-methylidene-(morpholin-4-ylmethyl)azanium?
The canonical SMILES for methyl-methylidene-(morpholin-4-ylmethyl)azanium is C=[N+](C)CN1CCOCC1.
What is the InChIKey of methyl-methylidene-(morpholin-4-ylmethyl)azanium?
The InChIKey is UKTLGWJCLTYMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N2O/c1-8(2)7-9-3-5-10-6-4-9/h1,3-7H2,2H3/q+1.
What are the key properties of methyl-methylidene-(morpholin-4-ylmethyl)azanium?
methyl-methylidene-(morpholin-4-ylmethyl)azanium has a molecular weight of 143.21 g/mol, XLogP of -0.38, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-methylidene-(morpholin-4-ylmethyl)azanium is sourced from PubChem (CID 91209028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).