1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine

C11H15BrN2O — CID 117269443

IUPAC1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine
SMILESC=C(CN1CCNCC1)c1ccc(Br)o1
InChIInChI=1S/C11H15BrN2O/c1-9(10-2-3-11(12)15-10)8-14-6-4-13-5-7-14/h2-3,13H,1,4-8H2
InChIKeyWQMQHSGNQQRGDN-UHFFFAOYSA-N
MW271.16 g/mol
LogP1.96
Rot. Bonds3

About 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine

1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine (PubChem CID 117269443) has the molecular formula C11H15BrN2O and a molecular weight of 271.16 g/mol. Its IUPAC name is 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine.

Molecular Properties

Compound Name1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine
PubChem CID117269443
Molecular FormulaC11H15BrN2O
Molecular Weight271.16 g/mol
Exact Mass270.04
IUPAC Name1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine
SMILESC=C(CN1CCNCC1)c1ccc(Br)o1
InChIInChI=1S/C11H15BrN2O/c1-9(10-2-3-11(12)15-10)8-14-6-4-13-5-7-14/h2-3,13H,1,4-8H2
InChIKeyWQMQHSGNQQRGDN-UHFFFAOYSA-N
XLogP1.96
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.16
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(5-bromofuran-2-yl)methyl]piperazine
CID 43143137
3-(5-bromofuran-2-yl)but-3-enoic acid
CID 117268810
2-[4-(2-piperazin-1-ylethyl)phenyl]ethanol
CID 84797085
1-[2-(3,4-difluorophenyl)prop-2-enyl]piperazine
CID 82511027
1-[2-(3-methylphenyl)prop-2-enyl]piperazine
CID 82509183
2-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]ethanethioamide
CID 55200605
(5-bromofuran-2-yl)-(2,2-dimethylpiperazin-1-yl)methanone
CID 65462950
N-[(5-bromofuran-2-yl)methyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide
CID 80548846
5-bromo-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)furan-2-carboxamide;hydrochloride
CID 120812658
2-[2-(piperazin-1-ylmethyl)prop-2-enyl]phenol
CID 117269462
1-[(4-bromophenyl)sulfanylmethyl]piperazine
CID 117033897
1-[2-[[3-(trifluoromethyl)phenyl]methyl]prop-2-enyl]piperazine
CID 117269449

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine?
The IUPAC name of 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine (CID 117269443) is 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine.
What is the SMILES notation for 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine?
The canonical SMILES for 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine is C=C(CN1CCNCC1)c1ccc(Br)o1.
What is the InChIKey of 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine?
The InChIKey is WQMQHSGNQQRGDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O/c1-9(10-2-3-11(12)15-10)8-14-6-4-13-5-7-14/h2-3,13H,1,4-8H2.
What are the key properties of 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine?
1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine has a molecular weight of 271.16 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-bromofuran-2-yl)prop-2-enyl]piperazine is sourced from PubChem (CID 117269443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).