[1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol

C15H19N3O — CID 83060230

IUPAC[1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol
SMILESNc1cccc2c(NC3(CO)CCCC3)ccnc12
InChIInChI=1S/C15H19N3O/c16-12-5-3-4-11-13(6-9-17-14(11)12)18-15(10-19)7-1-2-8-15/h3-6,9,19H,1-2,7-8,10,16H2,(H,17,18)
InChIKeyVKSJBOLSYMJTKL-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.53
Rot. Bonds3

About [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol

[1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol (PubChem CID 83060230) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol
PubChem CID83060230
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name[1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol
SMILESNc1cccc2c(NC3(CO)CCCC3)ccnc12
InChIInChI=1S/C15H19N3O/c16-12-5-3-4-11-13(6-9-17-14(11)12)18-15(10-19)7-1-2-8-15/h3-6,9,19H,1-2,7-8,10,16H2,(H,17,18)
InChIKeyVKSJBOLSYMJTKL-UHFFFAOYSA-N
XLogP2.53
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

[1-(3-amino-2-methylanilino)cyclopentyl]methanol
CID 63062925
4-N-[[1-(dimethylamino)cyclobutyl]methyl]quinoline-4,8-diamine
CID 105413899
4-[(8-aminoquinolin-4-yl)amino]butan-1-ol
CID 106840285
[1-[(8-aminoisoquinolin-5-yl)amino]cyclopentyl]methanol
CID 62523969
[1-[[(8-aminoquinolin-5-yl)amino]methyl]cyclopentyl]methanol
CID 115358035
[2-[(8-aminoquinolin-4-yl)amino]cyclohexyl]methanol
CID 106359240
4-N-[(2-methyloxolan-2-yl)methyl]quinoline-4,8-diamine
CID 83061056
4-N-cyclopropylquinoline-4,8-diamine
CID 83059537
4-N-[(2-methylthiolan-2-yl)methyl]quinoline-4,8-diamine
CID 83060985
[1-(3-amino-2-nitroanilino)cyclopentyl]methanol
CID 80833202
4-N-(2-methylbutan-2-yl)quinoline-4,8-diamine
CID 83058211
4-[(8-aminoquinolin-4-yl)amino]-3-methylbutan-1-ol
CID 83061124

Frequently Asked Questions

What is the IUPAC name of [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol?
The IUPAC name of [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol (CID 83060230) is [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol.
What is the SMILES notation for [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol?
The canonical SMILES for [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol is Nc1cccc2c(NC3(CO)CCCC3)ccnc12.
What is the InChIKey of [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol?
The InChIKey is VKSJBOLSYMJTKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c16-12-5-3-4-11-13(6-9-17-14(11)12)18-15(10-19)7-1-2-8-15/h3-6,9,19H,1-2,7-8,10,16H2,(H,17,18).
What are the key properties of [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol?
[1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol has a molecular weight of 257.34 g/mol, XLogP of 2.53, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(8-aminoquinolin-4-yl)amino]cyclopentyl]methanol is sourced from PubChem (CID 83060230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).