(1R)-1-(5-bromofuran-2-yl)pentan-1-amine

C9H14BrNO — CID 146012743

IUPAC(1R)-1-(5-bromofuran-2-yl)pentan-1-amine
SMILESCCCC[C@@H](N)c1ccc(Br)o1
InChIInChI=1S/C9H14BrNO/c1-2-3-4-7(11)8-5-6-9(10)12-8/h5-7H,2-4,11H2,1H3/t7-/m1/s1
InChIKeyNMUMZCXHZCFYET-SSDOTTSWSA-N
MW232.12 g/mol
LogP3.23
Rot. Bonds4

About (1R)-1-(5-bromofuran-2-yl)pentan-1-amine

(1R)-1-(5-bromofuran-2-yl)pentan-1-amine (PubChem CID 146012743) has the molecular formula C9H14BrNO and a molecular weight of 232.12 g/mol. Its IUPAC name is (1R)-1-(5-bromofuran-2-yl)pentan-1-amine.

Molecular Properties

Compound Name(1R)-1-(5-bromofuran-2-yl)pentan-1-amine
PubChem CID146012743
Molecular FormulaC9H14BrNO
Molecular Weight232.12 g/mol
Exact Mass231.03
IUPAC Name(1R)-1-(5-bromofuran-2-yl)pentan-1-amine
SMILESCCCC[C@@H](N)c1ccc(Br)o1
InChIInChI=1S/C9H14BrNO/c1-2-3-4-7(11)8-5-6-9(10)12-8/h5-7H,2-4,11H2,1H3/t7-/m1/s1
InChIKeyNMUMZCXHZCFYET-SSDOTTSWSA-N
XLogP3.23
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.12
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-(5-bromofuran-2-yl)butan-1-amine;hydrochloride
CID 171200029
(1S)-1-(5-bromofuran-2-yl)propane-1,3-diamine
CID 130817286
(1R)-1-(5-ethylfuran-2-yl)pentan-1-amine;hydrochloride
CID 171213544
(1S)-1-(5-bromofuran-2-yl)-3-fluoropropan-1-amine;hydrochloride
CID 171219569
1-(5-bromofuran-2-yl)-2-fluoroethanamine
CID 83820366
2-(5-bromofuran-2-yl)hexanenitrile
CID 70543529
1-(5-methylfuran-2-yl)hexan-1-amine;hydrochloride
CID 86262852
1-(5-bromofuran-2-yl)nonan-1-ol
CID 12603007
(1S)-1-(5-ethylfuran-2-yl)hexan-1-amine
CID 171233167
(1S)-1-(5-bromofuran-2-yl)-4,4,4-trifluorobutan-1-amine;hydrochloride
CID 171219567
N-[1-(5-bromofuran-2-yl)ethyl]hexan-2-amine
CID 104652943
1-(5-bromofuran-2-yl)hexylhydrazine
CID 105294743

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(5-bromofuran-2-yl)pentan-1-amine?
The IUPAC name of (1R)-1-(5-bromofuran-2-yl)pentan-1-amine (CID 146012743) is (1R)-1-(5-bromofuran-2-yl)pentan-1-amine.
What is the SMILES notation for (1R)-1-(5-bromofuran-2-yl)pentan-1-amine?
The canonical SMILES for (1R)-1-(5-bromofuran-2-yl)pentan-1-amine is CCCC[C@@H](N)c1ccc(Br)o1.
What is the InChIKey of (1R)-1-(5-bromofuran-2-yl)pentan-1-amine?
The InChIKey is NMUMZCXHZCFYET-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H14BrNO/c1-2-3-4-7(11)8-5-6-9(10)12-8/h5-7H,2-4,11H2,1H3/t7-/m1/s1.
What are the key properties of (1R)-1-(5-bromofuran-2-yl)pentan-1-amine?
(1R)-1-(5-bromofuran-2-yl)pentan-1-amine has a molecular weight of 232.12 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(5-bromofuran-2-yl)pentan-1-amine is sourced from PubChem (CID 146012743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).