1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine

C12H26N2O — CID 114593853

IUPAC1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine
SMILESCOCC(N)CN1CC(C)CC(C)C1C
InChIInChI=1S/C12H26N2O/c1-9-5-10(2)11(3)14(6-9)7-12(13)8-15-4/h9-12H,5-8,13H2,1-4H3
InChIKeyZMHQYBYSRMNHNZ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.33
Rot. Bonds4

About 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine

1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine (PubChem CID 114593853) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine
PubChem CID114593853
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine
SMILESCOCC(N)CN1CC(C)CC(C)C1C
InChIInChI=1S/C12H26N2O/c1-9-5-10(2)11(3)14(6-9)7-12(13)8-15-4/h9-12H,5-8,13H2,1-4H3
InChIKeyZMHQYBYSRMNHNZ-UHFFFAOYSA-N
XLogP1.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methoxy-1-(2,3,5-trimethylpiperidin-1-yl)butan-2-amine
CID 114593868
1-methoxy-N-propyl-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine
CID 107505960
ethyl 2-amino-3-(2,3,5-trimethylpiperidin-1-yl)propanoate
CID 114596345
1-phenyl-2-(2,3,5-trimethylpiperidin-1-yl)ethanamine
CID 114592777
2-(2,3,5-trimethylpiperidin-1-yl)ethanamine
CID 114592249
2-(propan-2-ylamino)-3-(2,3,5-trimethylpiperidin-1-yl)propanamide
CID 114596400
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-methoxypropan-2-amine
CID 104959190
3-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-3-amine
CID 114593805
1-(5-ethyl-2-methylmorpholin-4-yl)-3-methoxypropan-2-amine
CID 81101747
1-(2,4-difluorophenyl)-2-(2,3,5-trimethylpiperidin-1-yl)ethanamine
CID 107522072
2-(2,3,5-trimethylpiperidin-1-yl)ethanethiol
CID 114597780
4-(2,3,5-trimethylpiperidin-1-yl)butan-1-ol
CID 114594600

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine?
The IUPAC name of 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine (CID 114593853) is 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine.
What is the SMILES notation for 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine?
The canonical SMILES for 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine is COCC(N)CN1CC(C)CC(C)C1C.
What is the InChIKey of 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine?
The InChIKey is ZMHQYBYSRMNHNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-9-5-10(2)11(3)14(6-9)7-12(13)8-15-4/h9-12H,5-8,13H2,1-4H3.
What are the key properties of 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine?
1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine has a molecular weight of 214.35 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine is sourced from PubChem (CID 114593853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).