2-(4-cyclopropylpiperazin-1-yl)quinoline

C16H19N3 — CID 11324846

IUPAC2-(4-cyclopropylpiperazin-1-yl)quinoline
SMILESc1ccc2nc(N3CCN(C4CC4)CC3)ccc2c1
InChIInChI=1S/C16H19N3/c1-2-4-15-13(3-1)5-8-16(17-15)19-11-9-18(10-12-19)14-6-7-14/h1-5,8,14H,6-7,9-12H2
InChIKeyHOMYCGKCEABFJF-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.52
Rot. Bonds2

About 2-(4-cyclopropylpiperazin-1-yl)quinoline

2-(4-cyclopropylpiperazin-1-yl)quinoline (PubChem CID 11324846) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 2-(4-cyclopropylpiperazin-1-yl)quinoline.

Molecular Properties

Compound Name2-(4-cyclopropylpiperazin-1-yl)quinoline
PubChem CID11324846
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name2-(4-cyclopropylpiperazin-1-yl)quinoline
SMILESc1ccc2nc(N3CCN(C4CC4)CC3)ccc2c1
InChIInChI=1S/C16H19N3/c1-2-4-15-13(3-1)5-8-16(17-15)19-11-9-18(10-12-19)14-6-7-14/h1-5,8,14H,6-7,9-12H2
InChIKeyHOMYCGKCEABFJF-UHFFFAOYSA-N
XLogP2.52
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylpiperazin-1-yl)quinoline?
The IUPAC name of 2-(4-cyclopropylpiperazin-1-yl)quinoline (CID 11324846) is 2-(4-cyclopropylpiperazin-1-yl)quinoline.
What is the SMILES notation for 2-(4-cyclopropylpiperazin-1-yl)quinoline?
The canonical SMILES for 2-(4-cyclopropylpiperazin-1-yl)quinoline is c1ccc2nc(N3CCN(C4CC4)CC3)ccc2c1.
What is the InChIKey of 2-(4-cyclopropylpiperazin-1-yl)quinoline?
The InChIKey is HOMYCGKCEABFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c1-2-4-15-13(3-1)5-8-16(17-15)19-11-9-18(10-12-19)14-6-7-14/h1-5,8,14H,6-7,9-12H2.
What are the key properties of 2-(4-cyclopropylpiperazin-1-yl)quinoline?
2-(4-cyclopropylpiperazin-1-yl)quinoline has a molecular weight of 253.35 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylpiperazin-1-yl)quinoline is sourced from PubChem (CID 11324846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).