N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine

C14H30N2O — CID 106448993

IUPACN-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine
SMILESCCCOCCN1CCC(C(C)NCC)CC1
InChIInChI=1S/C14H30N2O/c1-4-11-17-12-10-16-8-6-14(7-9-16)13(3)15-5-2/h13-15H,4-12H2,1-3H3
InChIKeyISCKUPQFQBMNRQ-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.12
Rot. Bonds8

About N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine

N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine (PubChem CID 106448993) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine
PubChem CID106448993
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine
SMILESCCCOCCN1CCC(C(C)NCC)CC1
InChIInChI=1S/C14H30N2O/c1-4-11-17-12-10-16-8-6-14(7-9-16)13(3)15-5-2/h13-15H,4-12H2,1-3H3
InChIKeyISCKUPQFQBMNRQ-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine 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

1-[1-(2-ethoxyethyl)piperidin-4-yl]-N-methylethanamine
CID 63852723
N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-propoxypropan-1-amine
CID 82942170
N-ethyl-1-[1-[2-(3-methylbutoxy)ethyl]piperidin-3-yl]ethanamine
CID 63854629
N-[[1-(2-propoxyethyl)piperidin-4-yl]methyl]ethanamine
CID 106453503
N-ethyl-1-[1-(3-methoxy-3-methylbutyl)piperidin-4-yl]ethanamine
CID 103032460
N-[1-(1-butylpiperidin-4-yl)ethyl]propan-1-amine
CID 63855012
4-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-2-methylbutan-2-ol
CID 79359785
N-ethyl-1-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-3-yl]ethanamine
CID 55257799
(1S)-1-cyclopropyl-N-ethylethanamine
CID 42056539
N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine
CID 106455097
1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol
CID 103684371
1-cyclopropyl-N-[2-(4-propan-2-ylpiperidin-1-yl)ethyl]ethanamine
CID 103503465

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine?
The IUPAC name of N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine (CID 106448993) is N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine.
What is the SMILES notation for N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine?
The canonical SMILES for N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine is CCCOCCN1CCC(C(C)NCC)CC1.
What is the InChIKey of N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine?
The InChIKey is ISCKUPQFQBMNRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-4-11-17-12-10-16-8-6-14(7-9-16)13(3)15-5-2/h13-15H,4-12H2,1-3H3.
What are the key properties of N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine?
N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine has a molecular weight of 242.41 g/mol, XLogP of 2.12, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine is sourced from PubChem (CID 106448993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).