1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine

C11H19N3 — CID 143181551

IUPAC1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine
SMILESCC1C=C(N2CCN(C)CC2)N=CC1
InChIInChI=1S/C11H19N3/c1-10-3-4-12-11(9-10)14-7-5-13(2)6-8-14/h4,9-10H,3,5-8H2,1-2H3
InChIKeyVPLUMVZYLFRNBC-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.19
Rot. Bonds1

About 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine

1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine (PubChem CID 143181551) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine
PubChem CID143181551
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine
SMILESCC1C=C(N2CCN(C)CC2)N=CC1
InChIInChI=1S/C11H19N3/c1-10-3-4-12-11(9-10)14-7-5-13(2)6-8-14/h4,9-10H,3,5-8H2,1-2H3
InChIKeyVPLUMVZYLFRNBC-UHFFFAOYSA-N
XLogP1.19
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine?
The IUPAC name of 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine (CID 143181551) is 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine.
What is the SMILES notation for 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine?
The canonical SMILES for 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine is CC1C=C(N2CCN(C)CC2)N=CC1.
What is the InChIKey of 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine?
The InChIKey is VPLUMVZYLFRNBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-10-3-4-12-11(9-10)14-7-5-13(2)6-8-14/h4,9-10H,3,5-8H2,1-2H3.
What are the key properties of 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine?
1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine has a molecular weight of 193.29 g/mol, XLogP of 1.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(4-methyl-3,4-dihydropyridin-6-yl)piperazine is sourced from PubChem (CID 143181551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).