N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine

C14H30N2O2 — CID 55089422

IUPACN-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine
SMILESCCCOC1CCCN(CCNCCOCC)C1
InChIInChI=1S/C14H30N2O2/c1-3-11-18-14-6-5-9-16(13-14)10-7-15-8-12-17-4-2/h14-15H,3-13H2,1-2H3
InChIKeyBUXFXAUBBIBAMY-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.50
Rot. Bonds10

About N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine

N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine (PubChem CID 55089422) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine
PubChem CID55089422
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC NameN-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine
SMILESCCCOC1CCCN(CCNCCOCC)C1
InChIInChI=1S/C14H30N2O2/c1-3-11-18-14-6-5-9-16(13-14)10-7-15-8-12-17-4-2/h14-15H,3-13H2,1-2H3
InChIKeyBUXFXAUBBIBAMY-UHFFFAOYSA-N
XLogP1.50
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 ≤ 51.50
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

4-ethoxy-N-[2-(3-propoxypiperidin-1-yl)ethyl]butan-1-amine
CID 62557776
3-propan-2-yloxy-N-[2-(3-propoxypiperidin-1-yl)ethyl]propan-1-amine
CID 62558812
4-(3-propoxypiperidin-1-yl)-N-propylbutan-1-amine
CID 62411709
5-methyl-N-[2-(3-propoxypiperidin-1-yl)ethyl]hexan-2-amine
CID 62558297
N-[2-(3-propoxypiperidin-1-yl)ethyl]oxan-4-amine
CID 63098996
N-(2-ethoxyethyl)-2-piperidin-1-ylethanamine
CID 60697193
N-[3-(3-propoxypiperidin-1-yl)propyl]cyclopentanamine
CID 62563284
2-(3,4-dimethylpiperazin-1-yl)-N-(2-ethoxyethyl)ethanamine
CID 63620338
N-ethyl-4,4-dimethyl-1-(3-propoxypiperidin-1-yl)pentan-3-amine
CID 62624096
N,4,4-trimethyl-1-(3-propoxypiperidin-1-yl)pentan-3-amine
CID 55098092
N-ethyl-2-[(3-propoxypiperidin-1-yl)methyl]prop-2-en-1-amine
CID 103069920
2-[2-(3-propoxypiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine
CID 79577334

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine?
The IUPAC name of N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine (CID 55089422) is N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine.
What is the SMILES notation for N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine?
The canonical SMILES for N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine is CCCOC1CCCN(CCNCCOCC)C1.
What is the InChIKey of N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine?
The InChIKey is BUXFXAUBBIBAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-3-11-18-14-6-5-9-16(13-14)10-7-15-8-12-17-4-2/h14-15H,3-13H2,1-2H3.
What are the key properties of N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine?
N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine has a molecular weight of 258.41 g/mol, XLogP of 1.50, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-2-(3-propoxypiperidin-1-yl)ethanamine is sourced from PubChem (CID 55089422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).