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

C12H26N2O — CID 103225963

IUPAC2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine
SMILESCNCC(COC)N1CCC(C)CC1C
InChIInChI=1S/C12H26N2O/c1-10-5-6-14(11(2)7-10)12(8-13-3)9-15-4/h10-13H,5-9H2,1-4H3
InChIKeyVLRMXJFDLWUXOY-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.34
Rot. Bonds5

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

2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine (PubChem CID 103225963) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine
PubChem CID103225963
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine
SMILESCNCC(COC)N1CCC(C)CC1C
InChIInChI=1S/C12H26N2O/c1-10-5-6-14(11(2)7-10)12(8-13-3)9-15-4/h10-13H,5-9H2,1-4H3
InChIKeyVLRMXJFDLWUXOY-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine
CID 103227314
3-methoxy-N-methyl-2-(2-methylpiperidin-1-yl)propan-1-amine
CID 103225220
N-[2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxypropyl]-2-methylpropan-2-amine
CID 103227315
3-methoxy-2-(2-methylpyrrolidin-1-yl)-N-propan-2-ylpropan-1-amine
CID 103225175
3-methoxy-N-methyl-2-(2-propylpiperidin-1-yl)propan-1-amine
CID 103227164
2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine
CID 106675663
2-(2,4-dimethylpiperidin-1-yl)-N-propan-2-ylpentan-1-amine
CID 83054193
3-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)-N-methylpropan-1-amine
CID 103227407
2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxypropan-1-amine
CID 103227319
(2S,4R)-2,4-dimethyl-1-propan-2-ylpiperidine
CID 177325259
(2R,4R)-2,4-dimethyl-1-propan-2-ylpiperidine
CID 176766721
3-methoxy-N-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine
CID 103225740

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine?
The IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine (CID 103225963) is 2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine.
What is the SMILES notation for 2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine?
The canonical SMILES for 2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine is CNCC(COC)N1CCC(C)CC1C.
What is the InChIKey of 2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine?
The InChIKey is VLRMXJFDLWUXOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-10-5-6-14(11(2)7-10)12(8-13-3)9-15-4/h10-13H,5-9H2,1-4H3.
What are the key properties of 2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine?
2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine is sourced from PubChem (CID 103225963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).