4-methyl-N-phenylpiperazin-1-amine

C11H17N3 — CID 22361228

IUPAC4-methyl-N-phenylpiperazin-1-amine
SMILESCN1CCN(Nc2ccccc2)CC1
InChIInChI=1S/C11H17N3/c1-13-7-9-14(10-8-13)12-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3
InChIKeyWFPMWFUBUBIBOX-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.26
Rot. Bonds2

About 4-methyl-N-phenylpiperazin-1-amine

4-methyl-N-phenylpiperazin-1-amine (PubChem CID 22361228) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 4-methyl-N-phenylpiperazin-1-amine.

Molecular Properties

Compound Name4-methyl-N-phenylpiperazin-1-amine
PubChem CID22361228
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name4-methyl-N-phenylpiperazin-1-amine
SMILESCN1CCN(Nc2ccccc2)CC1
InChIInChI=1S/C11H17N3/c1-13-7-9-14(10-8-13)12-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3
InChIKeyWFPMWFUBUBIBOX-UHFFFAOYSA-N
XLogP1.26
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-phenylpiperazin-1-amine?
The IUPAC name of 4-methyl-N-phenylpiperazin-1-amine (CID 22361228) is 4-methyl-N-phenylpiperazin-1-amine.
What is the SMILES notation for 4-methyl-N-phenylpiperazin-1-amine?
The canonical SMILES for 4-methyl-N-phenylpiperazin-1-amine is CN1CCN(Nc2ccccc2)CC1.
What is the InChIKey of 4-methyl-N-phenylpiperazin-1-amine?
The InChIKey is WFPMWFUBUBIBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-13-7-9-14(10-8-13)12-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3.
What are the key properties of 4-methyl-N-phenylpiperazin-1-amine?
4-methyl-N-phenylpiperazin-1-amine has a molecular weight of 191.28 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-phenylpiperazin-1-amine is sourced from PubChem (CID 22361228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).