N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine

C12H26N2O — CID 82710396

IUPACN-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine
SMILESCCCN1CCCC(C(C)NOCC)C1
InChIInChI=1S/C12H26N2O/c1-4-8-14-9-6-7-12(10-14)11(3)13-15-5-2/h11-13H,4-10H2,1-3H3
InChIKeyKKRNNEUZHGZOFI-UHFFFAOYSA-N
MW214.35 g/mol
LogP2.04
Rot. Bonds6

About N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine

N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine (PubChem CID 82710396) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine.

Molecular Properties

Compound NameN-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine
PubChem CID82710396
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine
SMILESCCCN1CCCC(C(C)NOCC)C1
InChIInChI=1S/C12H26N2O/c1-4-8-14-9-6-7-12(10-14)11(3)13-15-5-2/h11-13H,4-10H2,1-3H3
InChIKeyKKRNNEUZHGZOFI-UHFFFAOYSA-N
XLogP2.04
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]butan-2-amine
CID 43308725
5-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]hexan-1-amine
CID 115325204
N-[1-(1-propylpiperidin-3-yl)ethyl]pentan-1-amine
CID 43307476
(1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol
CID 51697339
N-(oxan-4-ylmethyl)-1-(1-propylpiperidin-3-yl)ethanamine
CID 63726467
3-propan-2-yloxy-N-[1-(1-propylpiperidin-3-yl)ethyl]propan-1-amine
CID 43308556
3-[[1-(1-propylpiperidin-3-yl)ethylamino]methyl]pentan-3-ol
CID 65105569
3-methoxy-2-[1-(1-propylpiperidin-3-yl)ethylamino]propan-1-ol
CID 106186760
2,2-dimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propan-1-ol
CID 113293730
N-[1-(1-propylpiperidin-3-yl)ethyl]hex-5-yn-3-amine
CID 113477136
N-ethyl-1-(1-pentylpiperidin-3-yl)ethanamine
CID 63852706
4-iodo-N-[1-(1-propylpiperidin-3-yl)ethyl]aniline
CID 43308678

Frequently Asked Questions

What is the IUPAC name of N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine?
The IUPAC name of N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine (CID 82710396) is N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine.
What is the SMILES notation for N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine?
The canonical SMILES for N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine is CCCN1CCCC(C(C)NOCC)C1.
What is the InChIKey of N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine?
The InChIKey is KKRNNEUZHGZOFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-8-14-9-6-7-12(10-14)11(3)13-15-5-2/h11-13H,4-10H2,1-3H3.
What are the key properties of N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine?
N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine has a molecular weight of 214.35 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-1-(1-propylpiperidin-3-yl)ethanamine is sourced from PubChem (CID 82710396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).