(Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine

C11H23N3 — CID 139395126

IUPAC(Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine
SMILESCC/C(C)=C(\N)C(C)N1CCNCC1
InChIInChI=1S/C11H23N3/c1-4-9(2)11(12)10(3)14-7-5-13-6-8-14/h10,13H,4-8,12H2,1-3H3/b11-9-
InChIKeyMQXKICXONQKFMW-LUAWRHEFSA-N
MW197.33 g/mol
LogP0.92
Rot. Bonds3

About (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine

(Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine (PubChem CID 139395126) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine.

Molecular Properties

Compound Name(Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine
PubChem CID139395126
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name(Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine
SMILESCC/C(C)=C(\N)C(C)N1CCNCC1
InChIInChI=1S/C11H23N3/c1-4-9(2)11(12)10(3)14-7-5-13-6-8-14/h10,13H,4-8,12H2,1-3H3/b11-9-
InChIKeyMQXKICXONQKFMW-LUAWRHEFSA-N
XLogP0.92
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine?
The IUPAC name of (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine (CID 139395126) is (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine.
What is the SMILES notation for (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine?
The canonical SMILES for (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine is CC/C(C)=C(\N)C(C)N1CCNCC1.
What is the InChIKey of (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine?
The InChIKey is MQXKICXONQKFMW-LUAWRHEFSA-N. The full InChI is InChI=1S/C11H23N3/c1-4-9(2)11(12)10(3)14-7-5-13-6-8-14/h10,13H,4-8,12H2,1-3H3/b11-9-.
What are the key properties of (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine?
(Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine has a molecular weight of 197.33 g/mol, XLogP of 0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine is sourced from PubChem (CID 139395126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).