[1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol

C11H13N3O — CID 174723685

IUPAC[1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol
SMILESNCc1ccc(-n2cnc(CO)c2)cc1
InChIInChI=1S/C11H13N3O/c12-5-9-1-3-11(4-2-9)14-6-10(7-15)13-8-14/h1-4,6,8,15H,5,7,12H2
InChIKeyGKQOWNZLKAEPNE-UHFFFAOYSA-N
MW203.24 g/mol
LogP0.82
Rot. Bonds3

About [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol

[1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol (PubChem CID 174723685) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol.

Molecular Properties

Compound Name[1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol
PubChem CID174723685
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC Name[1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol
SMILESNCc1ccc(-n2cnc(CO)c2)cc1
InChIInChI=1S/C11H13N3O/c12-5-9-1-3-11(4-2-9)14-6-10(7-15)13-8-14/h1-4,6,8,15H,5,7,12H2
InChIKeyGKQOWNZLKAEPNE-UHFFFAOYSA-N
XLogP0.82
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(4-methylsulfanylphenyl)imidazol-4-yl]methanol
CID 23445034
[1-(3,4-dichlorophenyl)imidazol-4-yl]methanol
CID 23444980
2-[1-(4-ethylphenyl)imidazol-4-yl]ethanamine
CID 82471356
[1-(4-bromophenyl)imidazol-4-yl]methanamine
CID 82481393
[1-(4-fluoro-3-methylphenyl)imidazol-4-yl]methanol
CID 23445149
6-[4-[4-(hydroxymethyl)imidazol-1-yl]phenyl]-2-methylpyridazin-3-one
CID 68510946
[1-(1,3-dihydro-2-benzofuran-5-yl)imidazol-4-yl]methanol
CID 23445211
5-[4-(hydroxymethyl)imidazol-1-yl]-2-methylbenzonitrile
CID 175229447
[1-(5-bromo-3-pyridinyl)imidazol-4-yl]methanol
CID 130487124
6-[4-(hydroxymethyl)imidazol-1-yl]pyridin-3-ol
CID 176828851
[1-(5-bromo-2-pyridinyl)imidazol-4-yl]methanol
CID 68511931
[1-(2-methylphenyl)imidazol-4-yl]methanol
CID 70502575

Frequently Asked Questions

What is the IUPAC name of [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol?
The IUPAC name of [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol (CID 174723685) is [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol.
What is the SMILES notation for [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol?
The canonical SMILES for [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol is NCc1ccc(-n2cnc(CO)c2)cc1.
What is the InChIKey of [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol?
The InChIKey is GKQOWNZLKAEPNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c12-5-9-1-3-11(4-2-9)14-6-10(7-15)13-8-14/h1-4,6,8,15H,5,7,12H2.
What are the key properties of [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol?
[1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol has a molecular weight of 203.24 g/mol, XLogP of 0.82, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol is sourced from PubChem (CID 174723685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).