(5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine

C11H16BrNO — CID 107177989

IUPAC(5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine
SMILESCC1CCCC1C(N)c1ccc(Br)o1
InChIInChI=1S/C11H16BrNO/c1-7-3-2-4-8(7)11(13)9-5-6-10(12)14-9/h5-8,11H,2-4,13H2,1H3
InChIKeyFRWZOJKCVYAGCH-UHFFFAOYSA-N
MW258.16 g/mol
LogP3.48
Rot. Bonds2

About (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine

(5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine (PubChem CID 107177989) has the molecular formula C11H16BrNO and a molecular weight of 258.16 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine
PubChem CID107177989
Molecular FormulaC11H16BrNO
Molecular Weight258.16 g/mol
Exact Mass257.04
IUPAC Name(5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine
SMILESCC1CCCC1C(N)c1ccc(Br)o1
InChIInChI=1S/C11H16BrNO/c1-7-3-2-4-8(7)11(13)9-5-6-10(12)14-9/h5-8,11H,2-4,13H2,1H3
InChIKeyFRWZOJKCVYAGCH-UHFFFAOYSA-N
XLogP3.48
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.16
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-Methylfuran-2-yl)(2-methyloxolan-2-yl)methanamine
CID 80181790
[5-(4-Bromophenyl)furan-2-yl]methanamine
CID 16227286
(R)-1-(5-Bromofuran-2-yl)ethanamine hydrochloride
CID 145708424
(S)-1-(5-Bromofuran-2-yl)ethanamine hydrochloride
CID 145709034
1-(5-Methylfuran-2-yl)propan-1-amine
CID 14900058
1-(Furan-2-yl)-2-methylpropan-1-amine
CID 61712429
(1S)-2-fluoro-2-methyl-1-(5-methylfuran-2-yl)propan-1-amine
CID 58736279
2-(4-Bromophenyl)-1-[5-(trifluoromethyl)furan-2-yl]ethanamine
CID 137424254
1-[5-[(Z)-3-fluoroprop-1-enyl]-3,4-dimethylfuran-2-yl]propan-1-amine
CID 163587101
(5-Bromofuran-2-yl)-(4-fluorophenyl)methanamine
CID 43463931
(5-Bromofuran-2-yl)-(3,4-difluorophenyl)methanamine
CID 43464170
(5-Bromofuran-2-yl)-(2,4-difluorophenyl)methanamine
CID 43464215

Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine?
The IUPAC name of (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine (CID 107177989) is (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine.
What is the SMILES notation for (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine?
The canonical SMILES for (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine is CC1CCCC1C(N)c1ccc(Br)o1.
What is the InChIKey of (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine?
The InChIKey is FRWZOJKCVYAGCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrNO/c1-7-3-2-4-8(7)11(13)9-5-6-10(12)14-9/h5-8,11H,2-4,13H2,1H3.
What are the key properties of (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine?
(5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine has a molecular weight of 258.16 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromofuran-2-yl)-(2-methylcyclopentyl)methanamine is sourced from PubChem (CID 107177989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).