cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone

C15H19N3O2 — CID 32890940

IUPACcyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone
SMILESCc1cccc(C(=O)N2CCN(C(=O)C3CC3)CC2)n1
InChIInChI=1S/C15H19N3O2/c1-11-3-2-4-13(16-11)15(20)18-9-7-17(8-10-18)14(19)12-5-6-12/h2-4,12H,5-10H2,1H3
InChIKeyJEOHRWVJRZLROO-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.08
Rot. Bonds2

About cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone

cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone (PubChem CID 32890940) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone
PubChem CID32890940
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Namecyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone
SMILESCc1cccc(C(=O)N2CCN(C(=O)C3CC3)CC2)n1
InChIInChI=1S/C15H19N3O2/c1-11-3-2-4-13(16-11)15(20)18-9-7-17(8-10-18)14(19)12-5-6-12/h2-4,12H,5-10H2,1H3
InChIKeyJEOHRWVJRZLROO-UHFFFAOYSA-N
XLogP1.08
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone?
The IUPAC name of cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone (CID 32890940) is cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone is Cc1cccc(C(=O)N2CCN(C(=O)C3CC3)CC2)n1.
What is the InChIKey of cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone?
The InChIKey is JEOHRWVJRZLROO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-11-3-2-4-13(16-11)15(20)18-9-7-17(8-10-18)14(19)12-5-6-12/h2-4,12H,5-10H2,1H3.
What are the key properties of cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone?
cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone has a molecular weight of 273.34 g/mol, XLogP of 1.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]methanone is sourced from PubChem (CID 32890940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).