3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine

C12H26N2O2 — CID 103227407

IUPAC3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine
SMILESCNCC(COC)N1CCC(C)C(OC)C1
InChIInChI=1S/C12H26N2O2/c1-10-5-6-14(8-12(10)16-4)11(7-13-2)9-15-3/h10-13H,5-9H2,1-4H3
InChIKeyROVKBEUWBWLAET-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.58
Rot. Bonds6

About 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine

3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine (PubChem CID 103227407) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine
PubChem CID103227407
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine
SMILESCNCC(COC)N1CCC(C)C(OC)C1
InChIInChI=1S/C12H26N2O2/c1-10-5-6-14(8-12(10)16-4)11(7-13-2)9-15-3/h10-13H,5-9H2,1-4H3
InChIKeyROVKBEUWBWLAET-UHFFFAOYSA-N
XLogP0.58
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,4-dimethoxypyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine
CID 103539922
2-(3-methoxy-4-methylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 102967967
4,4-dimethoxy-2-(3-methoxy-4-methylpiperidin-1-yl)butan-1-amine
CID 102964864
3-methoxy-N-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine
CID 103225740
3-(3-methoxy-4-methylpiperidin-1-yl)-2-methyl-N-(2-methylpropyl)butan-1-amine
CID 102967905
3-(3-methoxy-4-methylpiperidin-1-yl)-N-propan-2-ylbutan-1-amine
CID 102968014
3-methoxy-N-methyl-2-(2-methylpiperidin-1-yl)propan-1-amine
CID 103225220
2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine
CID 103225963
2-(3-methoxy-4-methylpiperidin-1-yl)pentan-3-one
CID 102960462
2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine
CID 103227314
4-methoxy-2-[(3-methoxy-4-methylpiperidine-1-carbonyl)amino]butanoic acid
CID 102962656
2-(3-methoxy-4-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine
CID 102965010

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine?
The IUPAC name of 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine (CID 103227407) is 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine?
The canonical SMILES for 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine is CNCC(COC)N1CCC(C)C(OC)C1.
What is the InChIKey of 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine?
The InChIKey is ROVKBEUWBWLAET-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-10-5-6-14(8-12(10)16-4)11(7-13-2)9-15-3/h10-13H,5-9H2,1-4H3.
What are the key properties of 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine?
3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine has a molecular weight of 230.35 g/mol, XLogP of 0.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 103227407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).