2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol

C11H14N4O — CID 114705991

IUPAC2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol
SMILESCc1ccncc1-n1cncc1C(N)CO
InChIInChI=1S/C11H14N4O/c1-8-2-3-13-4-10(8)15-7-14-5-11(15)9(12)6-16/h2-5,7,9,16H,6,12H2,1H3
InChIKeyVIBITKMDNTUVQG-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.57
Rot. Bonds3

About 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol

2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol (PubChem CID 114705991) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol.

Molecular Properties

Compound Name2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol
PubChem CID114705991
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol
SMILESCc1ccncc1-n1cncc1C(N)CO
InChIInChI=1S/C11H14N4O/c1-8-2-3-13-4-10(8)15-7-14-5-11(15)9(12)6-16/h2-5,7,9,16H,6,12H2,1H3
InChIKeyVIBITKMDNTUVQG-UHFFFAOYSA-N
XLogP0.57
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-[[9-propan-2-yl-6-(pyridin-4-ylmethylamino)purin-2-yl]amino]butan-1-ol
CID 24782039
(2S)-2-[[9-propan-2-yl-6-(pyridin-4-ylmethylamino)purin-2-yl]amino]butan-1-ol
CID 10155152
2-(1-(3-methyl-2-buten-1-yl)-4-{[1-(2-pyrimidinyl)-1H-pyrrol-2-yl]methyl}-2-piperazinyl)ethanol
CID 16190757
5-(1-Methyl-1H-imidazol-5-yl)-2-pyridinamine
CID 57821741
2-{[(8-Methylimidazo[1,2-a]pyridin-3-yl)methyl]amino}propan-1-ol
CID 50981454
3-methyl-N-{2-[2-(tetrahydrofuran-3-yl)-1H-imidazol-1-yl]ethyl}pyridin-4-amine
CID 56914796
(2R)-2-[(4-imidazol-1-ylphenyl)methylamino]butan-1-ol
CID 57328259
1-Pentyl-4-pyridin-3-ylimidazol-2-amine;hydrochloride
CID 162675845
(2S)-3-methyl-2-[(6-pyridin-3-ylpyrazin-2-yl)amino]butan-1-ol
CID 172433884
(2S)-3-methyl-2-[(6-pyridin-3-ylimidazo[1,2-a]pyrazin-8-yl)amino]butan-1-ol
CID 172434241
(2R)-3-methyl-2-[(3-pyridin-4-ylpyrazin-2-yl)amino]butan-1-ol
CID 172435539
2-[5-Methyl-2-(pyridin-4-YL)-1H-imidazol-1-YL]ethan-1-amine
CID 91911586

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol?
The IUPAC name of 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol (CID 114705991) is 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol.
What is the SMILES notation for 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol?
The canonical SMILES for 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol is Cc1ccncc1-n1cncc1C(N)CO.
What is the InChIKey of 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol?
The InChIKey is VIBITKMDNTUVQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8-2-3-13-4-10(8)15-7-14-5-11(15)9(12)6-16/h2-5,7,9,16H,6,12H2,1H3.
What are the key properties of 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol?
2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol has a molecular weight of 218.26 g/mol, XLogP of 0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]ethanol is sourced from PubChem (CID 114705991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).