(1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol

C12H15N3O — CID 103938966

IUPAC(1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol
SMILESCC[C@@H](O)c1ccc(-n2ccnc2C)cn1
InChIInChI=1S/C12H15N3O/c1-3-12(16)11-5-4-10(8-14-11)15-7-6-13-9(15)2/h4-8,12,16H,3H2,1-2H3/t12-/m1/s1
InChIKeyYPQIQNMEARWFIJ-GFCCVEGCSA-N
MW217.27 g/mol
LogP2.02
Rot. Bonds3

About (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol

(1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol (PubChem CID 103938966) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol
PubChem CID103938966
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name(1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol
SMILESCC[C@@H](O)c1ccc(-n2ccnc2C)cn1
InChIInChI=1S/C12H15N3O/c1-3-12(16)11-5-4-10(8-14-11)15-7-6-13-9(15)2/h4-8,12,16H,3H2,1-2H3/t12-/m1/s1
InChIKeyYPQIQNMEARWFIJ-GFCCVEGCSA-N
XLogP2.02
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-pyridinyl]propan-1-ol
CID 113355424
1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-ol
CID 112585509
(1R)-1-[4-(2-methylimidazol-1-yl)phenyl]ethanol
CID 78941239
1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]ethanone
CID 83119576
N-methyl-5-(2-methylimidazol-1-yl)pyridin-2-amine
CID 169237415
5-(2-methylimidazol-1-yl)pyridine-2-carbothioamide
CID 115488775
5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide
CID 115489725
(1R)-1-[5-(4-chloro-3-methylpyrazol-1-yl)-2-pyridinyl]propan-1-ol
CID 103939000
(1S)-1-(5-thiomorpholin-4-yl-2-pyridinyl)propan-1-ol
CID 103938335
1-[5-(2-ethyl-5-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol
CID 112585503
(1R)-1-[5-(4,4-diethylpiperidin-1-yl)-2-pyridinyl]propan-1-ol
CID 103938741
1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-ol
CID 112585215

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol?
The IUPAC name of (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol (CID 103938966) is (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol.
What is the SMILES notation for (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol?
The canonical SMILES for (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol is CC[C@@H](O)c1ccc(-n2ccnc2C)cn1.
What is the InChIKey of (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol?
The InChIKey is YPQIQNMEARWFIJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H15N3O/c1-3-12(16)11-5-4-10(8-14-11)15-7-6-13-9(15)2/h4-8,12,16H,3H2,1-2H3/t12-/m1/s1.
What are the key properties of (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol?
(1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol has a molecular weight of 217.27 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-(2-methylimidazol-1-yl)-2-pyridinyl]propan-1-ol is sourced from PubChem (CID 103938966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).