(3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone

C16H15BrO2 — CID 63941252

IUPAC(3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone
SMILESO=C(c1occc1Br)C1(c2ccccc2)CCCC1
InChIInChI=1S/C16H15BrO2/c17-13-8-11-19-14(13)15(18)16(9-4-5-10-16)12-6-2-1-3-7-12/h1-3,6-8,11H,4-5,9-10H2
InChIKeyXDRSSRLOBVPLSH-UHFFFAOYSA-N
MW319.20 g/mol
LogP4.74
Rot. Bonds3

About (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone

(3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone (PubChem CID 63941252) has the molecular formula C16H15BrO2 and a molecular weight of 319.20 g/mol. Its IUPAC name is (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone.

Molecular Properties

Compound Name(3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone
PubChem CID63941252
Molecular FormulaC16H15BrO2
Molecular Weight319.20 g/mol
Exact Mass318.03
IUPAC Name(3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone
SMILESO=C(c1occc1Br)C1(c2ccccc2)CCCC1
InChIInChI=1S/C16H15BrO2/c17-13-8-11-19-14(13)15(18)16(9-4-5-10-16)12-6-2-1-3-7-12/h1-3,6-8,11H,4-5,9-10H2
InChIKeyXDRSSRLOBVPLSH-UHFFFAOYSA-N
XLogP4.74
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.20
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-N-(1-phenylcyclopropyl)furan-2-carboxamide
CID 75377332
(3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone
CID 130573801
furan-2-yl-(1-phenylcyclobutyl)methanone
CID 63947949
[1-(aminomethyl)cyclobutyl]-(3-bromofuran-2-yl)methanone
CID 116600348
(3-bromofuran-2-yl)-[1-(diethylamino)cyclopentyl]methanone
CID 79070400
(3-bromofuran-2-yl)-(2-methylpyrrolidin-2-yl)methanone
CID 116580497
1-phenylcyclopentane-1-carboxamide;dihydrochloride
CID 142770378
2-(3-bromofuran-2-yl)-2-oxoacetic acid
CID 130951949
(5-bromo-3-methyltriazol-4-yl)-(1-phenylcyclopentyl)methanone
CID 106461541
3-bromofuran-2-carbonyl bromide
CID 88622824
(3-bromofuran-2-yl)-[1-(dimethylamino)-4-methylcyclohexyl]methanone
CID 79067062
1-(1-phenylcyclopentyl)propan-1-one
CID 63080096

Frequently Asked Questions

What is the IUPAC name of (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone?
The IUPAC name of (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone (CID 63941252) is (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone.
What is the SMILES notation for (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone?
The canonical SMILES for (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone is O=C(c1occc1Br)C1(c2ccccc2)CCCC1.
What is the InChIKey of (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone?
The InChIKey is XDRSSRLOBVPLSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrO2/c17-13-8-11-19-14(13)15(18)16(9-4-5-10-16)12-6-2-1-3-7-12/h1-3,6-8,11H,4-5,9-10H2.
What are the key properties of (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone?
(3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone has a molecular weight of 319.20 g/mol, XLogP of 4.74, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromofuran-2-yl)-(1-phenylcyclopentyl)methanone is sourced from PubChem (CID 63941252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).