2-amino-2-(6-methylcinnolin-3-yl)ethanol

C11H13N3O — CID 83881552

IUPAC2-amino-2-(6-methylcinnolin-3-yl)ethanol
SMILESCc1ccc2nnc(C(N)CO)cc2c1
InChIInChI=1S/C11H13N3O/c1-7-2-3-10-8(4-7)5-11(14-13-10)9(12)6-15/h2-5,9,15H,6,12H2,1H3
InChIKeyJCWNKMDWKDDHRN-UHFFFAOYSA-N
MW203.24 g/mol
LogP0.93
Rot. Bonds2

About 2-amino-2-(6-methylcinnolin-3-yl)ethanol

2-amino-2-(6-methylcinnolin-3-yl)ethanol (PubChem CID 83881552) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is 2-amino-2-(6-methylcinnolin-3-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(6-methylcinnolin-3-yl)ethanol
PubChem CID83881552
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC Name2-amino-2-(6-methylcinnolin-3-yl)ethanol
SMILESCc1ccc2nnc(C(N)CO)cc2c1
InChIInChI=1S/C11H13N3O/c1-7-2-3-10-8(4-7)5-11(14-13-10)9(12)6-15/h2-5,9,15H,6,12H2,1H3
InChIKeyJCWNKMDWKDDHRN-UHFFFAOYSA-N
XLogP0.93
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-methylcinnolin-3-yl)propanoic acid
CID 83887030
6-methylcinnolin-3-amine
CID 142584156
(2S)-2-amino-2-(2,4-dimethylphenyl)ethanol
CID 42579716
2,7-dimethylacridine
CID 14490101
2-[(1S)-1-amino-2-hydroxyethyl]-5-methylphenol
CID 55277705
2-(1-amino-2-hydroxyethyl)-5-methylbenzaldehyde
CID 117277988
2-amino-2-[1-(2-methyl-1,3-benzothiazol-6-yl)triazol-4-yl]ethanol
CID 167809428
(2S)-2-amino-2-(2-iodo-5-methylphenyl)ethanol
CID 66515904
(2R)-2-amino-2-(2-fluoro-4-methylphenyl)ethanol;hydrochloride
CID 171221518
(2S)-2-amino-2-(2-fluoro-4-methylphenyl)ethanol;hydrochloride
CID 171201973
2-amino-2-(2-ethyl-5-methylphenyl)ethanol
CID 55283638
2,9-dimethylquinolino[2,3-b]acridine
CID 122407796

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(6-methylcinnolin-3-yl)ethanol?
The IUPAC name of 2-amino-2-(6-methylcinnolin-3-yl)ethanol (CID 83881552) is 2-amino-2-(6-methylcinnolin-3-yl)ethanol.
What is the SMILES notation for 2-amino-2-(6-methylcinnolin-3-yl)ethanol?
The canonical SMILES for 2-amino-2-(6-methylcinnolin-3-yl)ethanol is Cc1ccc2nnc(C(N)CO)cc2c1.
What is the InChIKey of 2-amino-2-(6-methylcinnolin-3-yl)ethanol?
The InChIKey is JCWNKMDWKDDHRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-7-2-3-10-8(4-7)5-11(14-13-10)9(12)6-15/h2-5,9,15H,6,12H2,1H3.
What are the key properties of 2-amino-2-(6-methylcinnolin-3-yl)ethanol?
2-amino-2-(6-methylcinnolin-3-yl)ethanol has a molecular weight of 203.24 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(6-methylcinnolin-3-yl)ethanol is sourced from PubChem (CID 83881552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).