2-amino-2-(2-methylquinolin-6-yl)propan-1-ol

C13H16N2O — CID 70880774

IUPAC2-amino-2-(2-methylquinolin-6-yl)propan-1-ol
SMILESCc1ccc2cc(C(C)(N)CO)ccc2n1
InChIInChI=1S/C13H16N2O/c1-9-3-4-10-7-11(13(2,14)8-16)5-6-12(10)15-9/h3-7,16H,8,14H2,1-2H3
InChIKeyBCFQGTDMBRNDGF-UHFFFAOYSA-N
MW216.28 g/mol
LogP1.71
Rot. Bonds2

About 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol

2-amino-2-(2-methylquinolin-6-yl)propan-1-ol (PubChem CID 70880774) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol.

Molecular Properties

Compound Name2-amino-2-(2-methylquinolin-6-yl)propan-1-ol
PubChem CID70880774
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name2-amino-2-(2-methylquinolin-6-yl)propan-1-ol
SMILESCc1ccc2cc(C(C)(N)CO)ccc2n1
InChIInChI=1S/C13H16N2O/c1-9-3-4-10-7-11(13(2,14)8-16)5-6-12(10)15-9/h3-7,16H,8,14H2,1-2H3
InChIKeyBCFQGTDMBRNDGF-UHFFFAOYSA-N
XLogP1.71
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol?
The IUPAC name of 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol (CID 70880774) is 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol.
What is the SMILES notation for 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol?
The canonical SMILES for 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol is Cc1ccc2cc(C(C)(N)CO)ccc2n1.
What is the InChIKey of 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol?
The InChIKey is BCFQGTDMBRNDGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-9-3-4-10-7-11(13(2,14)8-16)5-6-12(10)15-9/h3-7,16H,8,14H2,1-2H3.
What are the key properties of 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol?
2-amino-2-(2-methylquinolin-6-yl)propan-1-ol has a molecular weight of 216.28 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2-methylquinolin-6-yl)propan-1-ol is sourced from PubChem (CID 70880774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).