2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine

C12H17BrN2O — CID 106889465

IUPAC2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine
SMILESNC1CCCN(C2CC2)C1c1occc1Br
InChIInChI=1S/C12H17BrN2O/c13-9-5-7-16-12(9)11-10(14)2-1-6-15(11)8-3-4-8/h5,7-8,10-11H,1-4,6,14H2
InChIKeyDFWUCVQDSGQOGN-UHFFFAOYSA-N
MW285.19 g/mol
LogP2.67
Rot. Bonds2

About 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine

2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine (PubChem CID 106889465) has the molecular formula C12H17BrN2O and a molecular weight of 285.19 g/mol. Its IUPAC name is 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine.

Molecular Properties

Compound Name2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine
PubChem CID106889465
Molecular FormulaC12H17BrN2O
Molecular Weight285.19 g/mol
Exact Mass284.05
IUPAC Name2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine
SMILESNC1CCCN(C2CC2)C1c1occc1Br
InChIInChI=1S/C12H17BrN2O/c13-9-5-7-16-12(9)11-10(14)2-1-6-15(11)8-3-4-8/h5,7-8,10-11H,1-4,6,14H2
InChIKeyDFWUCVQDSGQOGN-UHFFFAOYSA-N
XLogP2.67
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.19
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-bromofuran-2-yl)-1-methylpyrrolidin-3-amine
CID 106889460
1-[3-(3-bromofuran-2-yl)-4-cyclopropylmorpholin-2-yl]-N-methylmethanamine
CID 106889429
N-[[2-(3-bromofuran-2-yl)-1-methylpiperidin-3-yl]methyl]propan-2-amine
CID 106889408
2-(4-bromo-5-methylthiophen-2-yl)-1-cyclopropylazepan-3-amine
CID 102844765
N-[[2-(3-bromofuran-2-yl)-1-methylazepan-3-yl]methyl]ethanamine
CID 106889430
1-[2-(3-bromofuran-2-yl)-1-propan-2-ylpyrrolidin-3-yl]-N-methylmethanamine
CID 106889418
2-(5-chloro-1,3-thiazol-2-yl)-1-cyclopropylpiperidin-3-amine
CID 107125602
[2-(2-bromo-5-chlorophenyl)-1-cyclopropylpiperidin-3-yl]methanamine
CID 66159366
[2-(4-bromo-3-methylphenyl)-1-cyclopropylpiperidin-3-yl]methanamine
CID 66481295
(3-bromofuran-2-yl)-(1-piperidin-4-ylpyrrolidin-2-yl)methanone
CID 116559716
1-cyclopropyl-2-(6-methoxy-2-pyridinyl)azepan-3-amine
CID 103348631
3-bromo-2-(3-bromocycloheptyl)furan
CID 64508976

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine?
The IUPAC name of 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine (CID 106889465) is 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine.
What is the SMILES notation for 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine?
The canonical SMILES for 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine is NC1CCCN(C2CC2)C1c1occc1Br.
What is the InChIKey of 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine?
The InChIKey is DFWUCVQDSGQOGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17BrN2O/c13-9-5-7-16-12(9)11-10(14)2-1-6-15(11)8-3-4-8/h5,7-8,10-11H,1-4,6,14H2.
What are the key properties of 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine?
2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine has a molecular weight of 285.19 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromofuran-2-yl)-1-cyclopropylpiperidin-3-amine is sourced from PubChem (CID 106889465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).