[2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone

C10H9N3O2 — CID 147710275

IUPAC[2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone
SMILESO=C(c1cccnc1CO)n1ccnc1
InChIInChI=1S/C10H9N3O2/c14-6-9-8(2-1-3-12-9)10(15)13-5-4-11-7-13/h1-5,7,14H,6H2
InChIKeyGUOIUGQESMUXRT-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.46
Rot. Bonds2

About [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone

[2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone (PubChem CID 147710275) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone.

Molecular Properties

Compound Name[2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone
PubChem CID147710275
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name[2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone
SMILESO=C(c1cccnc1CO)n1ccnc1
InChIInChI=1S/C10H9N3O2/c14-6-9-8(2-1-3-12-9)10(15)13-5-4-11-7-13/h1-5,7,14H,6H2
InChIKeyGUOIUGQESMUXRT-UHFFFAOYSA-N
XLogP0.46
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

imidazol-1-yl-(2-methyl-3-pyridinyl)methanone
CID 66563654
imidazol-1-yl-[2-(trifluoromethyl)phenyl]methanone
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[2-(dimethylamino)phenyl]-imidazol-1-ylmethanone
CID 110463462
(3-chloro-2-methylphenyl)-imidazol-1-ylmethanone
CID 110463733
imidazol-1-yl-[2-[4-(trifluoromethyl)phenyl]phenyl]methanone
CID 59710971
imidazol-1-yl-(2-octadecoxyphenyl)methanone
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acridin-4-yl(imidazol-1-yl)methanone
CID 10849851
imidazol-1-yl-(4-pyridin-2-ylphenyl)methanone
CID 110464843
1-imidazol-1-ylethanone;quinoline
CID 161093040
[4-[bis[(3-methyl-2-pyridinyl)methyl]amino]piperidin-1-yl]-imidazol-1-ylmethanone
CID 67271869
1-imidazol-1-yl-3-phenoxypropan-1-one
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imidazol-1-yl-(2-phenyl-1H-benzimidazol-4-yl)methanone
CID 69453516

Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone?
The IUPAC name of [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone (CID 147710275) is [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone.
What is the SMILES notation for [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone?
The canonical SMILES for [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone is O=C(c1cccnc1CO)n1ccnc1.
What is the InChIKey of [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone?
The InChIKey is GUOIUGQESMUXRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c14-6-9-8(2-1-3-12-9)10(15)13-5-4-11-7-13/h1-5,7,14H,6H2.
What are the key properties of [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone?
[2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone has a molecular weight of 203.20 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethyl)-3-pyridinyl]-imidazol-1-ylmethanone is sourced from PubChem (CID 147710275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).