amino(quinolin-2-yl)methanol

C10H10N2O — CID 154237779

IUPACamino(quinolin-2-yl)methanol
SMILESNC(O)c1ccc2ccccc2n1
InChIInChI=1S/C10H10N2O/c11-10(13)9-6-5-7-3-1-2-4-8(7)12-9/h1-6,10,13H,11H2
InChIKeyIWGOBRDSNKKIDB-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.18
Rot. Bonds1

About amino(quinolin-2-yl)methanol

amino(quinolin-2-yl)methanol (PubChem CID 154237779) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is amino(quinolin-2-yl)methanol.

Molecular Properties

Compound Nameamino(quinolin-2-yl)methanol
PubChem CID154237779
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Nameamino(quinolin-2-yl)methanol
SMILESNC(O)c1ccc2ccccc2n1
InChIInChI=1S/C10H10N2O/c11-10(13)9-6-5-7-3-1-2-4-8(7)12-9/h1-6,10,13H,11H2
InChIKeyIWGOBRDSNKKIDB-UHFFFAOYSA-N
XLogP1.18
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(1S)-2-amino-1-quinolin-2-ylethanol
CID 96808696
(1S)-1-quinolin-2-ylethanamine;hydrochloride
CID 171236571
(1R)-1-quinolin-2-ylethanamine;hydrochloride
CID 171216934
(3S)-3-amino-3-quinolin-2-ylpropan-1-ol
CID 96860354
2-amino-1-quinolin-2-ylbutan-1-ol
CID 64955097
amino(quinolin-2-yl)methanesulfinic acid
CID 66872593
1-quinolin-2-ylprop-2-en-1-ol
CID 65416491
(1S)-1-quinolin-2-ylpropan-1-amine;hydrochloride
CID 171236572
4-amino-1-quinolin-2-ylbutane-1,2-diol
CID 171881473
methyl (2R)-2-amino-2-quinolin-2-ylacetate
CID 131435940
(1R)-1-quinolin-2-ylbutane-1,4-diamine
CID 171216930
(1R)-3,3-difluoro-1-quinolin-2-ylpropan-1-amine
CID 171314038

Frequently Asked Questions

What is the IUPAC name of amino(quinolin-2-yl)methanol?
The IUPAC name of amino(quinolin-2-yl)methanol (CID 154237779) is amino(quinolin-2-yl)methanol.
What is the SMILES notation for amino(quinolin-2-yl)methanol?
The canonical SMILES for amino(quinolin-2-yl)methanol is NC(O)c1ccc2ccccc2n1.
What is the InChIKey of amino(quinolin-2-yl)methanol?
The InChIKey is IWGOBRDSNKKIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c11-10(13)9-6-5-7-3-1-2-4-8(7)12-9/h1-6,10,13H,11H2.
What are the key properties of amino(quinolin-2-yl)methanol?
amino(quinolin-2-yl)methanol has a molecular weight of 174.20 g/mol, XLogP of 1.18, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for amino(quinolin-2-yl)methanol is sourced from PubChem (CID 154237779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).