4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol

C15H19N3O — CID 43450840

IUPAC4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol
SMILESNc1ccc2nc(NC3CCC(O)CC3)ccc2c1
InChIInChI=1S/C15H19N3O/c16-11-2-7-14-10(9-11)1-8-15(18-14)17-12-3-5-13(19)6-4-12/h1-2,7-9,12-13,19H,3-6,16H2,(H,17,18)
InChIKeyBAKGLKZYRGCTQV-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.53
Rot. Bonds2

About 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol

4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol (PubChem CID 43450840) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol
PubChem CID43450840
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol
SMILESNc1ccc2nc(NC3CCC(O)CC3)ccc2c1
InChIInChI=1S/C15H19N3O/c16-11-2-7-14-10(9-11)1-8-15(18-14)17-12-3-5-13(19)6-4-12/h1-2,7-9,12-13,19H,3-6,16H2,(H,17,18)
InChIKeyBAKGLKZYRGCTQV-UHFFFAOYSA-N
XLogP2.53
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
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

2-N-cyclobutylquinoline-2,6-diamine
CID 62414145
2-N-(4-propylcyclohexyl)quinoline-2,6-diamine
CID 63402555
4-[(5,6-diamino-2-pyridinyl)amino]cyclohexan-1-ol
CID 79822536
2-N-(1,1-dioxothian-3-yl)quinoline-2,6-diamine
CID 63923297
5-[(6-aminoquinolin-2-yl)amino]-1-methylpiperidin-2-one
CID 64655505
2-N-(2,2-dimethylcyclopentyl)quinoline-2,6-diamine
CID 79861402
2-[[(6-aminoquinolin-2-yl)amino]methyl]cyclohexan-1-ol
CID 64929609
2-N-(2,2-dimethylcyclohexyl)quinoline-2,6-diamine
CID 79861490
4-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 80932012
2-N-(2-ethylcyclohexyl)quinoline-2,6-diamine
CID 63402589
2-N-(oxolan-2-ylmethyl)quinoline-2,6-diamine
CID 43383029
4-[(6-aminoquinazolin-4-yl)amino]cyclohexan-1-ol
CID 64587470

Frequently Asked Questions

What is the IUPAC name of 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol (CID 43450840) is 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol is Nc1ccc2nc(NC3CCC(O)CC3)ccc2c1.
What is the InChIKey of 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol?
The InChIKey is BAKGLKZYRGCTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c16-11-2-7-14-10(9-11)1-8-15(18-14)17-12-3-5-13(19)6-4-12/h1-2,7-9,12-13,19H,3-6,16H2,(H,17,18).
What are the key properties of 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol?
4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol has a molecular weight of 257.34 g/mol, XLogP of 2.53, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-aminoquinolin-2-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 43450840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).