N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine

C12H26N2O — CID 62580938

IUPACN-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine
SMILESCCCNCC1CCCCN1CCOC
InChIInChI=1S/C12H26N2O/c1-3-7-13-11-12-6-4-5-8-14(12)9-10-15-2/h12-13H,3-11H2,1-2H3
InChIKeyYAOQXYXKXKISQQ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.49
Rot. Bonds7

About N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine

N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine (PubChem CID 62580938) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine
PubChem CID62580938
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine
SMILESCCCNCC1CCCCN1CCOC
InChIInChI=1S/C12H26N2O/c1-3-7-13-11-12-6-4-5-8-14(12)9-10-15-2/h12-13H,3-11H2,1-2H3
InChIKeyYAOQXYXKXKISQQ-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-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

N-[[1-(4-methoxybutyl)piperidin-2-yl]methyl]propan-1-amine
CID 113436916
N-[[(2R)-1-propylpiperidin-2-yl]methyl]propan-1-amine
CID 97017290
N-[[1-[2-(3-methylbutoxy)ethyl]piperidin-2-yl]methyl]propan-1-amine
CID 62580582
N-[(1-nonylpiperidin-2-yl)methyl]propan-1-amine
CID 63527668
N-[[1-[2-(3-methoxypropoxy)ethyl]piperidin-2-yl]methyl]ethanamine
CID 103180300
2-methoxy-N-[[1-(methoxymethyl)piperidin-2-yl]methyl]ethanamine
CID 65364306
2-methoxy-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-2-yl]methyl]ethanamine
CID 82888085
2-methyl-4-[2-(propylaminomethyl)piperidin-1-yl]butan-2-ol
CID 79355208
N-(1-methoxypropan-2-yl)-2-[2-(propylaminomethyl)piperidin-1-yl]acetamide
CID 63847154
N-[[1-(2-ethylbutyl)piperidin-2-yl]methyl]-2-methoxyethanamine
CID 82924579
N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2,2-dimethylpropan-1-amine;hydrochloride
CID 115608918
5-[2-[(2-methoxyethylamino)methyl]piperidin-1-yl]pentanenitrile
CID 63855313

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine?
The IUPAC name of N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine (CID 62580938) is N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine.
What is the SMILES notation for N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine?
The canonical SMILES for N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine is CCCNCC1CCCCN1CCOC.
What is the InChIKey of N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine?
The InChIKey is YAOQXYXKXKISQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-3-7-13-11-12-6-4-5-8-14(12)9-10-15-2/h12-13H,3-11H2,1-2H3.
What are the key properties of N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine?
N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.49, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine is sourced from PubChem (CID 62580938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).