N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine

C13H26N2O — CID 62591849

IUPACN-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine
SMILESCOCCNCC1CCCN(CC2CC2)C1
InChIInChI=1S/C13H26N2O/c1-16-8-6-14-9-13-3-2-7-15(11-13)10-12-4-5-12/h12-14H,2-11H2,1H3
InChIKeyYEHDBNGLPCZXIN-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.34
Rot. Bonds7

About N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine

N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine (PubChem CID 62591849) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine.

Molecular Properties

Compound NameN-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine
PubChem CID62591849
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine
SMILESCOCCNCC1CCCN(CC2CC2)C1
InChIInChI=1S/C13H26N2O/c1-16-8-6-14-9-13-3-2-7-15(11-13)10-12-4-5-12/h12-14H,2-11H2,1H3
InChIKeyYEHDBNGLPCZXIN-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine 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-methoxy-N-[[1-(oxolan-3-ylmethyl)piperidin-3-yl]methyl]ethanamine
CID 62593612
N-[[1-(cyclobutylmethyl)piperidin-4-yl]methyl]-2-methoxyethanamine
CID 65459890
N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine
CID 65175473
2-methoxy-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-3-yl]methyl]ethanamine
CID 82887872
2-methoxy-N-[[1-(3-methylbutyl)piperidin-3-yl]methyl]ethanamine
CID 62593435
N-[[1-(2-ethylbutyl)piperidin-3-yl]methyl]-2-methoxyethanamine
CID 82925348
2-methoxy-N-[[1-(4-methylpentyl)piperidin-3-yl]methyl]ethanamine
CID 83158446
2-methoxy-N-[[1-(2-propan-2-yloxyethyl)piperidin-3-yl]methyl]ethanamine
CID 62592907
N-[[1-[(4-ethylmorpholin-2-yl)methyl]piperidin-3-yl]methyl]-2-methoxyethanamine
CID 79174620
N-[[1-(3-chloro-2-methylprop-2-enyl)piperidin-3-yl]methyl]-2-methoxyethanamine
CID 106438729
1-ethoxy-3-[3-[(2-methoxyethylamino)methyl]piperidin-1-yl]propan-2-ol
CID 63932403
N-[[1-(2-methoxyethyl)piperidin-3-yl]methyl]propan-1-amine
CID 62581675

Frequently Asked Questions

What is the IUPAC name of N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine?
The IUPAC name of N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine (CID 62591849) is N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine.
What is the SMILES notation for N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine?
The canonical SMILES for N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine is COCCNCC1CCCN(CC2CC2)C1.
What is the InChIKey of N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine?
The InChIKey is YEHDBNGLPCZXIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-16-8-6-14-9-13-3-2-7-15(11-13)10-12-4-5-12/h12-14H,2-11H2,1H3.
What are the key properties of N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine?
N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine has a molecular weight of 226.36 g/mol, XLogP of 1.34, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine is sourced from PubChem (CID 62591849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).