1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine

C14H28N2O2 — CID 66223606

IUPAC1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine
SMILESCOC(CN1CCC(N2CCCCC2)CC1)OC
InChIInChI=1S/C14H28N2O2/c1-17-14(18-2)12-15-10-6-13(7-11-15)16-8-4-3-5-9-16/h13-14H,3-12H2,1-2H3
InChIKeyIADZSENYXJUVNH-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.56
Rot. Bonds5

About 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine

1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine (PubChem CID 66223606) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine.

Molecular Properties

Compound Name1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine
PubChem CID66223606
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine
SMILESCOC(CN1CCC(N2CCCCC2)CC1)OC
InChIInChI=1S/C14H28N2O2/c1-17-14(18-2)12-15-10-6-13(7-11-15)16-8-4-3-5-9-16/h13-14H,3-12H2,1-2H3
InChIKeyIADZSENYXJUVNH-UHFFFAOYSA-N
XLogP1.56
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(3S)-1-(2,2-dimethoxyethyl)-3-piperidin-1-ylpiperidine
CID 99856888
(2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol
CID 103934988
1-[1-(2,2-dimethoxyethyl)pyrrolidin-3-yl]piperazine
CID 112739446
1-(2,2-dimethoxyethyl)piperidin-4-amine
CID 66221486
1-(azetidin-3-yl)-4-(2,2-dimethoxyethyl)piperazine
CID 81093537
1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol
CID 60966443
1-but-3-enyl-4-piperidin-1-ylpiperidine
CID 142831237
1-[(2-methylpropan-2-yl)oxy]-3-(4-pyrrolidin-1-ylpiperidin-1-yl)propan-2-ol
CID 110898534
1-(4-piperidin-1-ylpiperidin-1-yl)hex-4-yn-2-amine
CID 174081562
4-piperidin-1-yl-1-prop-2-enylpiperidine
CID 51086783
3-amino-4-(4-piperidin-1-ylpiperidin-1-yl)butan-1-ol
CID 64898995
methyl 2-(4-pyrrolidin-1-ylpiperidin-1-yl)acetate
CID 69424198

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine?
The IUPAC name of 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine (CID 66223606) is 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine.
What is the SMILES notation for 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine?
The canonical SMILES for 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine is COC(CN1CCC(N2CCCCC2)CC1)OC.
What is the InChIKey of 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine?
The InChIKey is IADZSENYXJUVNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-17-14(18-2)12-15-10-6-13(7-11-15)16-8-4-3-5-9-16/h13-14H,3-12H2,1-2H3.
What are the key properties of 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine?
1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine has a molecular weight of 256.39 g/mol, XLogP of 1.56, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine is sourced from PubChem (CID 66223606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).