2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride

C17H17ClN2O — CID 18432992

IUPAC2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride
SMILESCl.OCCNc1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C17H16N2O.ClH/c20-11-10-18-17-12-16(13-6-2-1-3-7-13)19-15-9-5-4-8-14(15)17;/h1-9,12,20H,10-11H2,(H,18,19);1H
InChIKeyAKPFVQVQPBWFEP-UHFFFAOYSA-N
MW300.79 g/mol
LogP3.73
Rot. Bonds4

About 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride

2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride (PubChem CID 18432992) has the molecular formula C17H17ClN2O and a molecular weight of 300.79 g/mol. Its IUPAC name is 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride.

Molecular Properties

Compound Name2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride
PubChem CID18432992
Molecular FormulaC17H17ClN2O
Molecular Weight300.79 g/mol
Exact Mass300.10
IUPAC Name2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride
SMILESCl.OCCNc1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C17H16N2O.ClH/c20-11-10-18-17-12-16(13-6-2-1-3-7-13)19-15-9-5-4-8-14(15)17;/h1-9,12,20H,10-11H2,(H,18,19);1H
InChIKeyAKPFVQVQPBWFEP-UHFFFAOYSA-N
XLogP3.73
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.79
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-bis(2-phenylquinolin-4-yl)octane-1,8-diamine;hydrochloride
CID 44531954
3-methyl-1-N-(2-phenylquinolin-4-yl)butane-1,3-diamine;dihydrochloride
CID 90459061
2-phenyl-N-(2-piperidin-1-ylethyl)quinolin-4-amine;dihydrochloride
CID 45050904
2-[[7-methoxy-2-(4-methoxyphenyl)quinolin-4-yl]amino]ethanol;hydrochloride
CID 18433040
bis(N',N'-dimethyl-N-(2-naphthalen-2-ylquinolin-4-yl)propane-1,3-diamine);dihydrochloride
CID 157354468
2-phenyl-N-(2-pyrrolidin-2-ylethyl)quinolin-4-amine
CID 130365852
3-[[2-(4-methylphenyl)quinolin-4-yl]amino]propane-1,2-diol
CID 18433090
2-[(2-phenylquinazolin-4-yl)amino]ethanol;hydrochloride
CID 2789481
deuterio-(2-phenylquinolin-4-yl)methanol
CID 88591215
1-amino-3-[[2-(3,4-dichlorophenyl)quinolin-4-yl]amino]propan-2-ol;hydrochloride
CID 18433113
2-[2-[4-[4-(2-hydroxyethylamino)phenyl]phenyl]quinolin-4-yl]acetohydrazide
CID 90304223
N-(4-bromophenyl)-2-phenylquinolin-4-amine;hydrochloride
CID 139593880

Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride?
The IUPAC name of 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride (CID 18432992) is 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride.
What is the SMILES notation for 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride?
The canonical SMILES for 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride is Cl.OCCNc1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride?
The InChIKey is AKPFVQVQPBWFEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O.ClH/c20-11-10-18-17-12-16(13-6-2-1-3-7-13)19-15-9-5-4-8-14(15)17;/h1-9,12,20H,10-11H2,(H,18,19);1H.
What are the key properties of 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride?
2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride has a molecular weight of 300.79 g/mol, XLogP of 3.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenylquinolin-4-yl)amino]ethanol;hydrochloride is sourced from PubChem (CID 18432992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).