(1R)-1-methoxy-N',N'-dimethylmethanediamine

C4H12N2O — CID 130458479

IUPAC(1R)-1-methoxy-N',N'-dimethylmethanediamine
SMILESCO[C@H](N)N(C)C
InChIInChI=1S/C4H12N2O/c1-6(2)4(5)7-3/h4H,5H2,1-3H3/t4-/m1/s1
InChIKeyXYMRNXRUGDWSAA-SCSAIBSYSA-N
MW104.15 g/mol
LogP-0.56
Rot. Bonds2

About (1R)-1-methoxy-N',N'-dimethylmethanediamine

(1R)-1-methoxy-N',N'-dimethylmethanediamine (PubChem CID 130458479) has the molecular formula C4H12N2O and a molecular weight of 104.15 g/mol. Its IUPAC name is (1R)-1-methoxy-N',N'-dimethylmethanediamine.

Molecular Properties

Compound Name(1R)-1-methoxy-N',N'-dimethylmethanediamine
PubChem CID130458479
Molecular FormulaC4H12N2O
Molecular Weight104.15 g/mol
Exact Mass104.09
IUPAC Name(1R)-1-methoxy-N',N'-dimethylmethanediamine
SMILESCO[C@H](N)N(C)C
InChIInChI=1S/C4H12N2O/c1-6(2)4(5)7-3/h4H,5H2,1-3H3/t4-/m1/s1
InChIKeyXYMRNXRUGDWSAA-SCSAIBSYSA-N
XLogP-0.56
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.15
LogP ≤ 5-0.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,1-dimethoxy-N,N-dimethylmethanamine;ethane
CID 91602918
(1S)-1-methoxy-N,N-dimethylethanamine
CID 89341126
amino(trimethoxy)phosphanium
CID 87744644
1-methoxyethanamine
CID 19353429
(1R)-1-N',1-N'-dimethylpropane-1,1-diamine
CID 92569177
[[[azanidyl(methyl)amino]-methoxymethyl]-methylamino]azanide
CID 163646166
1-methoxy-N,N,2-trimethylbutan-1-amine
CID 91572935
1,3,5-triazine-2,4,6-triamine;trimethoxymethane
CID 135335672
1-methoxyethylphosphane
CID 18189169
1,2-dimethoxy-N,N,4-trimethylpentan-1-amine
CID 87595068
(2S,3R)-2-(dimethylamino)-3-methoxybutanamide
CID 89440516
(1S)-1-(dimethylamino)ethanol
CID 93477761

Frequently Asked Questions

What is the IUPAC name of (1R)-1-methoxy-N',N'-dimethylmethanediamine?
The IUPAC name of (1R)-1-methoxy-N',N'-dimethylmethanediamine (CID 130458479) is (1R)-1-methoxy-N',N'-dimethylmethanediamine.
What is the SMILES notation for (1R)-1-methoxy-N',N'-dimethylmethanediamine?
The canonical SMILES for (1R)-1-methoxy-N',N'-dimethylmethanediamine is CO[C@H](N)N(C)C.
What is the InChIKey of (1R)-1-methoxy-N',N'-dimethylmethanediamine?
The InChIKey is XYMRNXRUGDWSAA-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H12N2O/c1-6(2)4(5)7-3/h4H,5H2,1-3H3/t4-/m1/s1.
What are the key properties of (1R)-1-methoxy-N',N'-dimethylmethanediamine?
(1R)-1-methoxy-N',N'-dimethylmethanediamine has a molecular weight of 104.15 g/mol, XLogP of -0.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-methoxy-N',N'-dimethylmethanediamine is sourced from PubChem (CID 130458479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).