4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine

C18H35N3 — CID 58850388

IUPAC4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine
SMILESCC(C)N1CCC(N2CCC(N3CCCCC3)CC2)CC1
InChIInChI=1S/C18H35N3/c1-16(2)19-12-6-18(7-13-19)21-14-8-17(9-15-21)20-10-4-3-5-11-20/h16-18H,3-15H2,1-2H3
InChIKeyUKKZAGDJOMIEIA-UHFFFAOYSA-N
MW293.50 g/mol
LogP2.81
Rot. Bonds3

About 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine

4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine (PubChem CID 58850388) has the molecular formula C18H35N3 and a molecular weight of 293.50 g/mol. Its IUPAC name is 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine.

Molecular Properties

Compound Name4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine
PubChem CID58850388
Molecular FormulaC18H35N3
Molecular Weight293.50 g/mol
Exact Mass293.28
IUPAC Name4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine
SMILESCC(C)N1CCC(N2CCC(N3CCCCC3)CC2)CC1
InChIInChI=1S/C18H35N3/c1-16(2)19-12-6-18(7-13-19)21-14-8-17(9-15-21)20-10-4-3-5-11-20/h16-18H,3-15H2,1-2H3
InChIKeyUKKZAGDJOMIEIA-UHFFFAOYSA-N
XLogP2.81
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine?
The IUPAC name of 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine (CID 58850388) is 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine.
What is the SMILES notation for 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine?
The canonical SMILES for 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine is CC(C)N1CCC(N2CCC(N3CCCCC3)CC2)CC1.
What is the InChIKey of 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine?
The InChIKey is UKKZAGDJOMIEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3/c1-16(2)19-12-6-18(7-13-19)21-14-8-17(9-15-21)20-10-4-3-5-11-20/h16-18H,3-15H2,1-2H3.
What are the key properties of 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine?
4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine has a molecular weight of 293.50 g/mol, XLogP of 2.81, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-1-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine is sourced from PubChem (CID 58850388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).