2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol

C17H17N3O — CID 114754949

IUPAC2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol
SMILESCc1cc(C(O)Cc2ccnc(N)c2)nc2ccccc12
InChIInChI=1S/C17H17N3O/c1-11-8-15(20-14-5-3-2-4-13(11)14)16(21)9-12-6-7-19-17(18)10-12/h2-8,10,16,21H,9H2,1H3,(H2,18,19)
InChIKeyXSBGUXOTOUXJDD-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.80
Rot. Bonds3

About 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol

2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol (PubChem CID 114754949) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol.

Molecular Properties

Compound Name2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol
PubChem CID114754949
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol
SMILESCc1cc(C(O)Cc2ccnc(N)c2)nc2ccccc12
InChIInChI=1S/C17H17N3O/c1-11-8-15(20-14-5-3-2-4-13(11)14)16(21)9-12-6-7-19-17(18)10-12/h2-8,10,16,21H,9H2,1H3,(H2,18,19)
InChIKeyXSBGUXOTOUXJDD-UHFFFAOYSA-N
XLogP2.80
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol
CID 114754909
(1R)-1-(4-methylquinolin-2-yl)butan-1-ol
CID 104969389
2-(2-amino-4-pyridinyl)-1-isoquinolin-4-ylethanol
CID 104504582
1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol
CID 114754836
2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol
CID 103347981
2-(2-amino-4-pyridinyl)-1-(6-methoxypyrimidin-4-yl)ethanol
CID 102950454
2-(4-methylquinolin-2-yl)pyrimidin-4-amine
CID 114755416
(2-ethylpyrazol-3-yl)-(4-methylquinolin-2-yl)methanol
CID 114754847
2-(2-amino-4-pyridinyl)-1-(2-ethylpyrazol-3-yl)ethanol
CID 114556816
3-(2-amino-4-pyridinyl)-1,1-difluoropropan-2-ol
CID 112575631
2-(1-ethylimidazol-2-yl)-1-(4-methylquinolin-2-yl)ethanamine
CID 114755024
[4-methyl-1-(4-methylquinolin-2-yl)pent-4-enyl]hydrazine
CID 105279669

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol?
The IUPAC name of 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol (CID 114754949) is 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol.
What is the SMILES notation for 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol?
The canonical SMILES for 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol is Cc1cc(C(O)Cc2ccnc(N)c2)nc2ccccc12.
What is the InChIKey of 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol?
The InChIKey is XSBGUXOTOUXJDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-11-8-15(20-14-5-3-2-4-13(11)14)16(21)9-12-6-7-19-17(18)10-12/h2-8,10,16,21H,9H2,1H3,(H2,18,19).
What are the key properties of 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol?
2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol has a molecular weight of 279.34 g/mol, XLogP of 2.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol is sourced from PubChem (CID 114754949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).