[1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol

C12H25N3O — CID 79656436

IUPAC[1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol
SMILESCCN1CCN(C2CCC(N)(CO)C2)CC1
InChIInChI=1S/C12H25N3O/c1-2-14-5-7-15(8-6-14)11-3-4-12(13,9-11)10-16/h11,16H,2-10,13H2,1H3
InChIKeyZAWZRDVKSSBFMW-UHFFFAOYSA-N
MW227.35 g/mol
LogP-0.13
Rot. Bonds3

About [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol

[1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol (PubChem CID 79656436) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol
PubChem CID79656436
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name[1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol
SMILESCCN1CCN(C2CCC(N)(CO)C2)CC1
InChIInChI=1S/C12H25N3O/c1-2-14-5-7-15(8-6-14)11-3-4-12(13,9-11)10-16/h11,16H,2-10,13H2,1H3
InChIKeyZAWZRDVKSSBFMW-UHFFFAOYSA-N
XLogP-0.13
TPSA52.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-amino-3-(4-ethylpiperidin-1-yl)cyclopentyl]methanol
CID 79655902
[1-amino-3-(4-propan-2-ylazepan-1-yl)cyclopentyl]methanol
CID 79656554
[1-amino-3-(3,5-dimethylpiperidin-1-yl)cyclopentyl]methanol
CID 79656844
[1-amino-3-(3-ethyl-4-methylpiperazin-1-yl)cyclopentyl]methanol
CID 79655931
[1-amino-3-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]cyclohexyl]methanol
CID 79635510
3-(4-ethylpiperazin-1-yl)-1-(methylamino)cyclopentane-1-carboxylic acid
CID 79649771
[1-amino-3-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]cyclohexyl]methanol
CID 79634375
[1-amino-3-(3-azabicyclo[3.3.1]nonan-3-yl)cyclopentyl]methanol
CID 114196891
[1-amino-3-(4-butan-2-ylpiperazin-1-yl)cyclohexyl]methanol
CID 79634360
[1-amino-3-(3-ethoxypiperidin-1-yl)cyclopentyl]methanol
CID 79656230
[1-amino-3-(3-ethylpiperidin-1-yl)cyclohexyl]methanol
CID 79640939
[1-amino-3-[4-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanol
CID 79634523

Frequently Asked Questions

What is the IUPAC name of [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol?
The IUPAC name of [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol (CID 79656436) is [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol.
What is the SMILES notation for [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol?
The canonical SMILES for [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol is CCN1CCN(C2CCC(N)(CO)C2)CC1.
What is the InChIKey of [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol?
The InChIKey is ZAWZRDVKSSBFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-2-14-5-7-15(8-6-14)11-3-4-12(13,9-11)10-16/h11,16H,2-10,13H2,1H3.
What are the key properties of [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol?
[1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol has a molecular weight of 227.35 g/mol, XLogP of -0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol is sourced from PubChem (CID 79656436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).