[1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol

C14H20BrNO — CID 154243294

IUPAC[1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol
SMILESCCNC1CCCC1(CO)c1ccc(Br)cc1
InChIInChI=1S/C14H20BrNO/c1-2-16-13-4-3-9-14(13,10-17)11-5-7-12(15)8-6-11/h5-8,13,16-17H,2-4,9-10H2,1H3
InChIKeyGOCLFOWVSJTBIS-UHFFFAOYSA-N
MW298.22 g/mol
LogP2.84
Rot. Bonds4

About [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol

[1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol (PubChem CID 154243294) has the molecular formula C14H20BrNO and a molecular weight of 298.22 g/mol. Its IUPAC name is [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol
PubChem CID154243294
Molecular FormulaC14H20BrNO
Molecular Weight298.22 g/mol
Exact Mass297.07
IUPAC Name[1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol
SMILESCCNC1CCCC1(CO)c1ccc(Br)cc1
InChIInChI=1S/C14H20BrNO/c1-2-16-13-4-3-9-14(13,10-17)11-5-7-12(15)8-6-11/h5-8,13,16-17H,2-4,9-10H2,1H3
InChIKeyGOCLFOWVSJTBIS-UHFFFAOYSA-N
XLogP2.84
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.22
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1R,2R)-2-(ethylamino)-1-methylcyclopentan-1-ol
CID 166556336
1-(4-bromophenyl)-N-ethylcyclopropan-1-amine
CID 126991156
2-[[2-(4-bromophenyl)acetyl]amino]-1-methylcyclopentane-1-carboxylic acid
CID 82760341
trans-(1S,2S)-1-(4-bromophenyl)-2-(2,2-dimethylhydrazinyl)cyclohexan-1-ol
CID 102137510
[2-[(5-bromopyrimidin-2-yl)amino]-1-methylcyclopentyl]methanol
CID 71998147
[2-[(5-chlorofuran-2-yl)methylamino]-1-methylcyclopentyl]methanol
CID 115655341
1-(4-bromophenyl)-2-methylcyclopentan-1-amine
CID 79679716
1-[1-(4-bromophenyl)-2-methylcyclopropyl]-N-methylmethanamine
CID 83729543
4-bromo-N-[1-(hydroxymethyl)-3-methylcyclohexyl]benzenesulfonamide
CID 62527403
4-[[1-(4-bromophenyl)cyclobutyl]methylamino]cyclohexane-1-carboxylic acid
CID 122030564
2-[[2-(4-bromophenyl)sulfanylacetyl]amino]-1-methylcyclopentane-1-carboxylic acid
CID 82765679
2-(4-bromophenyl)sulfonyl-N-ethylcycloheptan-1-amine
CID 64645455

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol?
The IUPAC name of [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol (CID 154243294) is [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol.
What is the SMILES notation for [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol?
The canonical SMILES for [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol is CCNC1CCCC1(CO)c1ccc(Br)cc1.
What is the InChIKey of [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol?
The InChIKey is GOCLFOWVSJTBIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrNO/c1-2-16-13-4-3-9-14(13,10-17)11-5-7-12(15)8-6-11/h5-8,13,16-17H,2-4,9-10H2,1H3.
What are the key properties of [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol?
[1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol has a molecular weight of 298.22 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromophenyl)-2-(ethylamino)cyclopentyl]methanol is sourced from PubChem (CID 154243294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).