N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine

C11H21N3 — CID 145292616

IUPACN-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine
SMILESC=C(NC)C1CN(C)CCN1C(=C)C
InChIInChI=1S/C11H21N3/c1-9(2)14-7-6-13(5)8-11(14)10(3)12-4/h11-12H,1,3,6-8H2,2,4-5H3
InChIKeyYHIVEZIOOWYOSK-UHFFFAOYSA-N
MW195.31 g/mol
LogP0.87
Rot. Bonds3

About N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine

N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine (PubChem CID 145292616) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine.

Molecular Properties

Compound NameN-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine
PubChem CID145292616
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC NameN-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine
SMILESC=C(NC)C1CN(C)CCN1C(=C)C
InChIInChI=1S/C11H21N3/c1-9(2)14-7-6-13(5)8-11(14)10(3)12-4/h11-12H,1,3,6-8H2,2,4-5H3
InChIKeyYHIVEZIOOWYOSK-UHFFFAOYSA-N
XLogP0.87
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine?
The IUPAC name of N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine (CID 145292616) is N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine.
What is the SMILES notation for N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine?
The canonical SMILES for N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine is C=C(NC)C1CN(C)CCN1C(=C)C.
What is the InChIKey of N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine?
The InChIKey is YHIVEZIOOWYOSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-9(2)14-7-6-13(5)8-11(14)10(3)12-4/h11-12H,1,3,6-8H2,2,4-5H3.
What are the key properties of N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine?
N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine has a molecular weight of 195.31 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methyl-1-prop-1-en-2-ylpiperazin-2-yl)ethenamine is sourced from PubChem (CID 145292616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).