(Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine

C12H24N4 — CID 70504319

IUPAC(Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine
SMILESC/C=C(\N)CN1CCN(C/C(N)=C/C)CC1
InChIInChI=1S/C12H24N4/c1-3-11(13)9-15-5-7-16(8-6-15)10-12(14)4-2/h3-4H,5-10,13-14H2,1-2H3/b11-3-,12-4-
InChIKeyHYWBFBMNALALKX-LPPGRIHKSA-N
MW224.35 g/mol
LogP0.33
Rot. Bonds4

About (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine

(Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine (PubChem CID 70504319) has the molecular formula C12H24N4 and a molecular weight of 224.35 g/mol. Its IUPAC name is (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine.

Molecular Properties

Compound Name(Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine
PubChem CID70504319
Molecular FormulaC12H24N4
Molecular Weight224.35 g/mol
Exact Mass224.20
IUPAC Name(Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine
SMILESC/C=C(\N)CN1CCN(C/C(N)=C/C)CC1
InChIInChI=1S/C12H24N4/c1-3-11(13)9-15-5-7-16(8-6-15)10-12(14)4-2/h3-4H,5-10,13-14H2,1-2H3/b11-3-,12-4-
InChIKeyHYWBFBMNALALKX-LPPGRIHKSA-N
XLogP0.33
TPSA58.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine?
The IUPAC name of (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine (CID 70504319) is (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine.
What is the SMILES notation for (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine?
The canonical SMILES for (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine is C/C=C(\N)CN1CCN(C/C(N)=C/C)CC1.
What is the InChIKey of (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine?
The InChIKey is HYWBFBMNALALKX-LPPGRIHKSA-N. The full InChI is InChI=1S/C12H24N4/c1-3-11(13)9-15-5-7-16(8-6-15)10-12(14)4-2/h3-4H,5-10,13-14H2,1-2H3/b11-3-,12-4-.
What are the key properties of (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine?
(Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine has a molecular weight of 224.35 g/mol, XLogP of 0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[4-[(Z)-2-aminobut-2-enyl]piperazin-1-yl]but-2-en-2-amine is sourced from PubChem (CID 70504319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).