4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine

C12H26N2O — CID 102963557

IUPAC4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine
SMILESCOC1CN(CCC(C)(C)N)CCC1C
InChIInChI=1S/C12H26N2O/c1-10-5-7-14(9-11(10)15-4)8-6-12(2,3)13/h10-11H,5-9,13H2,1-4H3
InChIKeyCOPFLNJNGQPFCF-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.47
Rot. Bonds4

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

4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine (PubChem CID 102963557) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine.

Molecular Properties

Compound Name4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine
PubChem CID102963557
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine
SMILESCOC1CN(CCC(C)(C)N)CCC1C
InChIInChI=1S/C12H26N2O/c1-10-5-7-14(9-11(10)15-4)8-6-12(2,3)13/h10-11H,5-9,13H2,1-4H3
InChIKeyCOPFLNJNGQPFCF-UHFFFAOYSA-N
XLogP1.47
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 ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-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

2-amino-5-(3-methoxy-4-methylpiperidin-1-yl)-2-methylpentanoic acid
CID 102966380
2-(3-methoxy-4-methylpiperidin-1-yl)ethanethiol
CID 102969172
4-(3-methoxy-4-methylpiperidin-1-yl)butan-1-amine
CID 102956570
5-(3-methoxy-4-methylpiperidin-1-yl)-2,2-dimethylpentanoic acid
CID 102968597
2-(cyclopropylamino)-4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutanoic acid
CID 102966377
N'-hydroxy-5-(3-methoxy-4-methylpiperidin-1-yl)-2,2-dimethylpentanimidamide
CID 102958330
1-(6-chlorohexyl)-3-methoxy-4-methylpiperidine
CID 102964339
N-ethyl-4-(3-methoxy-4-methylpiperidin-1-yl)butan-2-amine
CID 102963478
(2S)-1-(3-methoxy-4-methylpiperidin-1-yl)propan-2-amine
CID 102965393
1-(3-methoxy-4-methylpiperidin-1-yl)-3,3-dimethylbutan-2-one
CID 102960525
N-(2-methoxyethyl)-2-(3-methoxy-4-methylpiperidin-1-yl)ethanamine
CID 102963614
1-(3-amino-3-methylbutyl)piperidin-3-ol
CID 82405665

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine?
The IUPAC name of 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine (CID 102963557) is 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine.
What is the SMILES notation for 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine?
The canonical SMILES for 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine is COC1CN(CCC(C)(C)N)CCC1C.
What is the InChIKey of 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine?
The InChIKey is COPFLNJNGQPFCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-10-5-7-14(9-11(10)15-4)8-6-12(2,3)13/h10-11H,5-9,13H2,1-4H3.
What are the key properties of 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine?
4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine has a molecular weight of 214.35 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxy-4-methylpiperidin-1-yl)-2-methylbutan-2-amine is sourced from PubChem (CID 102963557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).