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

C14H30N2O2 — CID 65175473

IUPACN-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine
SMILESCCOCCCN1CCCC(CNCCOC)C1
InChIInChI=1S/C14H30N2O2/c1-3-18-10-5-9-16-8-4-6-14(13-16)12-15-7-11-17-2/h14-15H,3-13H2,1-2H3
InChIKeySERIGRMBYUJMNQ-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.36
Rot. Bonds10

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

N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine (PubChem CID 65175473) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine.

Molecular Properties

Compound NameN-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine
PubChem CID65175473
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC NameN-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine
SMILESCCOCCCN1CCCC(CNCCOC)C1
InChIInChI=1S/C14H30N2O2/c1-3-18-10-5-9-16-8-4-6-14(13-16)12-15-7-11-17-2/h14-15H,3-13H2,1-2H3
InChIKeySERIGRMBYUJMNQ-UHFFFAOYSA-N
XLogP1.36
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-N-[[1-[3-(2,2,2-trifluoroethoxy)propyl]piperidin-3-yl]methyl]ethanamine
CID 62593259
2-methoxy-N-[[1-(4-methylpentyl)piperidin-3-yl]methyl]ethanamine
CID 83158446
N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine
CID 62591849
4-[3-[(2-methoxyethylamino)methyl]piperidin-1-yl]-N,N-dimethylbutanamide
CID 63847458
N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methylpropan-1-amine
CID 65175422
2-methoxy-N-[[1-(3-methylbutyl)piperidin-3-yl]methyl]ethanamine
CID 62593435
2-methoxy-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-3-yl]methyl]ethanamine
CID 82887872
N-[[1-(2-methoxyethyl)piperidin-3-yl]methyl]propan-1-amine
CID 62581675
1-ethoxy-3-[3-[(2-methoxyethylamino)methyl]piperidin-1-yl]propan-2-ol
CID 63932403
2-methoxy-N-[[1-(2-propan-2-yloxyethyl)piperidin-3-yl]methyl]ethanamine
CID 62592907
N-[[1-(2-ethylbutyl)piperidin-3-yl]methyl]-2-methoxyethanamine
CID 82925348
4-[3-[(2-methoxyethylamino)methyl]piperidin-1-yl]-2,2-dimethylbutanenitrile
CID 65251196

Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine?
The IUPAC name of N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine (CID 65175473) is N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine.
What is the SMILES notation for N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine?
The canonical SMILES for N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine is CCOCCCN1CCCC(CNCCOC)C1.
What is the InChIKey of N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine?
The InChIKey is SERIGRMBYUJMNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-3-18-10-5-9-16-8-4-6-14(13-16)12-15-7-11-17-2/h14-15H,3-13H2,1-2H3.
What are the key properties of N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine?
N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine has a molecular weight of 258.41 g/mol, XLogP of 1.36, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methoxyethanamine is sourced from PubChem (CID 65175473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).