N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine

C11H24N2O2 — CID 62392397

IUPACN-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine
SMILESCOCCN(C)CC1(CN)CCOCC1
InChIInChI=1S/C11H24N2O2/c1-13(5-8-14-2)10-11(9-12)3-6-15-7-4-11/h3-10,12H2,1-2H3
InChIKeyLLRHCYWNWTZHKQ-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.32
Rot. Bonds6

About N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine

N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine (PubChem CID 62392397) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine.

Molecular Properties

Compound NameN-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine
PubChem CID62392397
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine
SMILESCOCCN(C)CC1(CN)CCOCC1
InChIInChI=1S/C11H24N2O2/c1-13(5-8-14-2)10-11(9-12)3-6-15-7-4-11/h3-10,12H2,1-2H3
InChIKeyLLRHCYWNWTZHKQ-UHFFFAOYSA-N
XLogP0.32
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine with MolForge

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Related Compounds

1-(4-((Dimethylamino)methyl)oxan-4-yl)methanamine dihydrochloride
CID 138987893
(5R)-2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine
CID 129231197
1-{4-[(Dimethylamino)methyl]oxan-4-yl}methanamine
CID 62390590
[4-(Methylaminomethyl)oxan-4-yl]methanamine
CID 115440031
2-Propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine
CID 129231152
(5R)-2-butan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine
CID 129237414
2-[(3S)-4-methylmorpholin-3-yl]butan-1-amine
CID 156300290
(5R)-2-ethyl-7-oxa-2-azaspiro[3.5]nonan-5-amine
CID 156829554
(5R)-2-butyl-7-oxa-2-azaspiro[3.5]nonan-5-amine
CID 166705893
4-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxan-4-amine
CID 54985666
2-ethyl-2-(morpholin-4-ylmethyl)-N-propylbutan-1-amine
CID 55051993
N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]pentan-1-amine
CID 55065945

Frequently Asked Questions

What is the IUPAC name of N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine?
The IUPAC name of N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine (CID 62392397) is N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine.
What is the SMILES notation for N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine?
The canonical SMILES for N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine is COCCN(C)CC1(CN)CCOCC1.
What is the InChIKey of N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine?
The InChIKey is LLRHCYWNWTZHKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-13(5-8-14-2)10-11(9-12)3-6-15-7-4-11/h3-10,12H2,1-2H3.
What are the key properties of N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine?
N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine has a molecular weight of 216.32 g/mol, XLogP of 0.32, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(aminomethyl)oxan-4-yl]methyl]-2-methoxy-N-methylethanamine is sourced from PubChem (CID 62392397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).