(1S)-1-methoxy-N,N-dimethylethanamine

C5H13NO — CID 89341126

IUPAC(1S)-1-methoxy-N,N-dimethylethanamine
SMILESCO[C@@H](C)N(C)C
InChIInChI=1S/C5H13NO/c1-5(7-4)6(2)3/h5H,1-4H3/t5-/m0/s1
InChIKeyBGGVJKGMDWLNRC-YFKPBYRVSA-N
MW103.16 g/mol
LogP0.54
Rot. Bonds2

About (1S)-1-methoxy-N,N-dimethylethanamine

(1S)-1-methoxy-N,N-dimethylethanamine (PubChem CID 89341126) has the molecular formula C5H13NO and a molecular weight of 103.16 g/mol. Its IUPAC name is (1S)-1-methoxy-N,N-dimethylethanamine.

Molecular Properties

Compound Name(1S)-1-methoxy-N,N-dimethylethanamine
PubChem CID89341126
Molecular FormulaC5H13NO
Molecular Weight103.16 g/mol
Exact Mass103.10
IUPAC Name(1S)-1-methoxy-N,N-dimethylethanamine
SMILESCO[C@@H](C)N(C)C
InChIInChI=1S/C5H13NO/c1-5(7-4)6(2)3/h5H,1-4H3/t5-/m0/s1
InChIKeyBGGVJKGMDWLNRC-YFKPBYRVSA-N
XLogP0.54
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.16
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-Dimethyl-2-methoxyethylamine
CID 547400
3-methoxy-N,N-dimethylpropan-1-amine
CID 547431
N-(Methoxymethyl)-diethylamine
CID 4182376
N-(Ethoxymethyl)diethylamine
CID 81812
ethanaminium, 2-hydroxy-n,n,n-trimethyl-, inner salt
CID 170746
4-Methoxy-N,N-dimethylbut-2-yn-1-amine
CID 339027
1-ethoxy-N,N-dimethylmethanamine
CID 296577
N-(ethoxymethyl)-N,N-dimethylethanaminium chloride
CID 14619871
1-methoxy-N,N-dimethylpropan-1-amine
CID 22062441
1-methoxy-N,N-dimethylethanamine
CID 22505825
Sodium diethylaminoethoxide
CID 23672346
Sodium dimethylaminoethoxide
CID 86586345

Frequently Asked Questions

What is the IUPAC name of (1S)-1-methoxy-N,N-dimethylethanamine?
The IUPAC name of (1S)-1-methoxy-N,N-dimethylethanamine (CID 89341126) is (1S)-1-methoxy-N,N-dimethylethanamine.
What is the SMILES notation for (1S)-1-methoxy-N,N-dimethylethanamine?
The canonical SMILES for (1S)-1-methoxy-N,N-dimethylethanamine is CO[C@@H](C)N(C)C.
What is the InChIKey of (1S)-1-methoxy-N,N-dimethylethanamine?
The InChIKey is BGGVJKGMDWLNRC-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H13NO/c1-5(7-4)6(2)3/h5H,1-4H3/t5-/m0/s1.
What are the key properties of (1S)-1-methoxy-N,N-dimethylethanamine?
(1S)-1-methoxy-N,N-dimethylethanamine has a molecular weight of 103.16 g/mol, XLogP of 0.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-methoxy-N,N-dimethylethanamine is sourced from PubChem (CID 89341126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).