2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol

C18H18N2O — CID 132590331

IUPAC2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol
SMILESCC(C)(O)c1nc2ccccc2c(-c2ccccc2)c1N
InChIInChI=1S/C18H18N2O/c1-18(2,21)17-16(19)15(12-8-4-3-5-9-12)13-10-6-7-11-14(13)20-17/h3-11,21H,19H2,1-2H3
InChIKeyVHPFVQQABKYUFA-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.71
Rot. Bonds2

About 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol

2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol (PubChem CID 132590331) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol
PubChem CID132590331
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol
SMILESCC(C)(O)c1nc2ccccc2c(-c2ccccc2)c1N
InChIInChI=1S/C18H18N2O/c1-18(2,21)17-16(19)15(12-8-4-3-5-9-12)13-10-6-7-11-14(13)20-17/h3-11,21H,19H2,1-2H3
InChIKeyVHPFVQQABKYUFA-UHFFFAOYSA-N
XLogP3.71
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-amino-6-chloro-4-phenylquinolin-2-yl)pentan-3-ol
CID 132590343
3-(3-amino-6-bromo-4-phenylquinolin-2-yl)pentan-3-ol
CID 132590342
3-tert-butyl-4-phenylisoquinolin-1-amine
CID 58517608
2,4,6-triphenylbenzene-1,3,5-triamine
CID 22926582
3-(aminomethyl)-4-phenylquinolin-2-amine
CID 10285988
3,4-bis(4-methylphenyl)quinolin-2-amine
CID 102531411
2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol
CID 132590349
3-acridin-9-ylaniline
CID 87131444
9-phenylacridin-4-ol
CID 59256664
acridin-9-amine;λ2-plumbane
CID 173496858
N'-amino-2-methyl-4-phenylquinoline-3-carboximidamide
CID 144584922
2-(2-methylbutan-2-yloxy)-9-phenylacridine
CID 175443882

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol?
The IUPAC name of 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol (CID 132590331) is 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol.
What is the SMILES notation for 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol?
The canonical SMILES for 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol is CC(C)(O)c1nc2ccccc2c(-c2ccccc2)c1N.
What is the InChIKey of 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol?
The InChIKey is VHPFVQQABKYUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-18(2,21)17-16(19)15(12-8-4-3-5-9-12)13-10-6-7-11-14(13)20-17/h3-11,21H,19H2,1-2H3.
What are the key properties of 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol?
2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol has a molecular weight of 278.36 g/mol, XLogP of 3.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-4-phenylquinolin-2-yl)propan-2-ol is sourced from PubChem (CID 132590331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).