N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine

C15H25N3O — CID 43166978

IUPACN-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine
SMILESCCOCCCNC1CCN(c2ccncc2)CC1
InChIInChI=1S/C15H25N3O/c1-2-19-13-3-8-17-14-6-11-18(12-7-14)15-4-9-16-10-5-15/h4-5,9-10,14,17H,2-3,6-8,11-13H2,1H3
InChIKeyMAIXUNCKFHRGGS-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.07
Rot. Bonds7

About N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine

N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine (PubChem CID 43166978) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine
PubChem CID43166978
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine
SMILESCCOCCCNC1CCN(c2ccncc2)CC1
InChIInChI=1S/C15H25N3O/c1-2-19-13-3-8-17-14-6-11-18(12-7-14)15-4-9-16-10-5-15/h4-5,9-10,14,17H,2-3,6-8,11-13H2,1H3
InChIKeyMAIXUNCKFHRGGS-UHFFFAOYSA-N
XLogP2.07
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.07
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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Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine?
The IUPAC name of N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine (CID 43166978) is N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine.
What is the SMILES notation for N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine?
The canonical SMILES for N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine is CCOCCCNC1CCN(c2ccncc2)CC1.
What is the InChIKey of N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine?
The InChIKey is MAIXUNCKFHRGGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-2-19-13-3-8-17-14-6-11-18(12-7-14)15-4-9-16-10-5-15/h4-5,9-10,14,17H,2-3,6-8,11-13H2,1H3.
What are the key properties of N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine?
N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine has a molecular weight of 263.38 g/mol, XLogP of 2.07, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine is sourced from PubChem (CID 43166978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).