amino-(4-methylphenyl)methanol

C8H11NO — CID 70304176

IUPACamino-(4-methylphenyl)methanol
SMILESCc1ccc(C(N)O)cc1
InChIInChI=1S/C8H11NO/c1-6-2-4-7(5-3-6)8(9)10/h2-5,8,10H,9H2,1H3
InChIKeyWDZRLNFEYJHEAA-UHFFFAOYSA-N
MW137.18 g/mol
LogP0.94
Rot. Bonds1

About amino-(4-methylphenyl)methanol

amino-(4-methylphenyl)methanol (PubChem CID 70304176) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is amino-(4-methylphenyl)methanol.

Molecular Properties

Compound Nameamino-(4-methylphenyl)methanol
PubChem CID70304176
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Nameamino-(4-methylphenyl)methanol
SMILESCc1ccc(C(N)O)cc1
InChIInChI=1S/C8H11NO/c1-6-2-4-7(5-3-6)8(9)10/h2-5,8,10H,9H2,1H3
InChIKeyWDZRLNFEYJHEAA-UHFFFAOYSA-N
XLogP0.94
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3R)-3-amino-3-(4-methylphenyl)propane-1,1-diol
CID 163794645
bromo-(4-methylphenyl)methanamine
CID 22286716
(4-methylphenyl)-[4-(4-methylphenyl)phenyl]methanol
CID 143325793
N-[amino-(4-methylphenyl)methyl]hydroxylamine
CID 142151488
(2R,3S)-3-amino-2-hydroxy-3-(4-methylphenyl)propanoic acid
CID 67807121
2-amino-1-(4-methylphenyl)ethanol;ethane
CID 145260878
(1S)-1-amino-2-methyl-1-(4-methylphenyl)propan-2-ol
CID 144598850
amino-(4-methylsulfonylphenyl)methanol
CID 116939660
(1S)-1-(4-methylphenyl)propan-1-amine
CID 7028357
(2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide
CID 119293211
2,3-dihydroxy-3-(4-methylphenyl)propanamide
CID 171867589
(1R)-1-(4-methylphenyl)propan-1-ol;propane
CID 144859103

Frequently Asked Questions

What is the IUPAC name of amino-(4-methylphenyl)methanol?
The IUPAC name of amino-(4-methylphenyl)methanol (CID 70304176) is amino-(4-methylphenyl)methanol.
What is the SMILES notation for amino-(4-methylphenyl)methanol?
The canonical SMILES for amino-(4-methylphenyl)methanol is Cc1ccc(C(N)O)cc1.
What is the InChIKey of amino-(4-methylphenyl)methanol?
The InChIKey is WDZRLNFEYJHEAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-6-2-4-7(5-3-6)8(9)10/h2-5,8,10H,9H2,1H3.
What are the key properties of amino-(4-methylphenyl)methanol?
amino-(4-methylphenyl)methanol has a molecular weight of 137.18 g/mol, XLogP of 0.94, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for amino-(4-methylphenyl)methanol is sourced from PubChem (CID 70304176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).