2-(3-bromophenyl)-3-cyclopentylpropan-1-ol

C14H19BrO — CID 79443530

IUPAC2-(3-bromophenyl)-3-cyclopentylpropan-1-ol
SMILESOCC(CC1CCCC1)c1cccc(Br)c1
InChIInChI=1S/C14H19BrO/c15-14-7-3-6-12(9-14)13(10-16)8-11-4-1-2-5-11/h3,6-7,9,11,13,16H,1-2,4-5,8,10H2
InChIKeyDECKUWMEASZIJV-UHFFFAOYSA-N
MW283.21 g/mol
LogP4.11
Rot. Bonds4

About 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol

2-(3-bromophenyl)-3-cyclopentylpropan-1-ol (PubChem CID 79443530) has the molecular formula C14H19BrO and a molecular weight of 283.21 g/mol. Its IUPAC name is 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol.

Molecular Properties

Compound Name2-(3-bromophenyl)-3-cyclopentylpropan-1-ol
PubChem CID79443530
Molecular FormulaC14H19BrO
Molecular Weight283.21 g/mol
Exact Mass282.06
IUPAC Name2-(3-bromophenyl)-3-cyclopentylpropan-1-ol
SMILESOCC(CC1CCCC1)c1cccc(Br)c1
InChIInChI=1S/C14H19BrO/c15-14-7-3-6-12(9-14)13(10-16)8-11-4-1-2-5-11/h3,6-7,9,11,13,16H,1-2,4-5,8,10H2
InChIKeyDECKUWMEASZIJV-UHFFFAOYSA-N
XLogP4.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.21
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-bromophenyl)-2-cyclobutylethanol
CID 65457872
2-(3-bromophenyl)-3-(cyclopropylamino)propan-1-ol
CID 117242819
[1-(3-bromophenyl)-2-cyclohexylethyl]hydrazine
CID 105197948
4-amino-2-(3-bromophenyl)butan-1-ol
CID 115045172
1-bromo-3-(2-chloro-3-cyclopentylpropyl)benzene
CID 63542179
1-(3-bromophenyl)sulfanyl-3-cyclopentylpropan-2-ol
CID 66145491
N-[2-(3-bromophenyl)-3-(oxan-4-yl)propyl]cyclopropanamine
CID 79442605
3-(3-bromophenyl)-3-cyclobutylpropanal
CID 115049694
(S)-(3-bromophenyl)-cyclohexylmethanamine
CID 93312550
1-(3-bromophenoxy)-3-cyclopentylpropan-2-ol
CID 103160598
2-(3-bromophenyl)-2-(cyclopentylmethoxy)ethanamine
CID 66323008
2-(3-bromophenyl)-N-(cyclobutylmethyl)propan-1-amine
CID 115876148

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol?
The IUPAC name of 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol (CID 79443530) is 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol.
What is the SMILES notation for 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol?
The canonical SMILES for 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol is OCC(CC1CCCC1)c1cccc(Br)c1.
What is the InChIKey of 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol?
The InChIKey is DECKUWMEASZIJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrO/c15-14-7-3-6-12(9-14)13(10-16)8-11-4-1-2-5-11/h3,6-7,9,11,13,16H,1-2,4-5,8,10H2.
What are the key properties of 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol?
2-(3-bromophenyl)-3-cyclopentylpropan-1-ol has a molecular weight of 283.21 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)-3-cyclopentylpropan-1-ol is sourced from PubChem (CID 79443530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).