2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide

C15H16FN3O2 — CID 68660884

IUPAC2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNc1ncc(-c2cccc(F)c2)cc1O
InChIInChI=1S/C15H16FN3O2/c1-19(2)14(21)9-18-15-13(20)7-11(8-17-15)10-4-3-5-12(16)6-10/h3-8,20H,9H2,1-2H3,(H,17,18)
InChIKeyOBSNNDQWGFDERT-UHFFFAOYSA-N
MW289.31 g/mol
LogP2.09
Rot. Bonds4

About 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide

2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide (PubChem CID 68660884) has the molecular formula C15H16FN3O2 and a molecular weight of 289.31 g/mol. Its IUPAC name is 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide
PubChem CID68660884
Molecular FormulaC15H16FN3O2
Molecular Weight289.31 g/mol
Exact Mass289.12
IUPAC Name2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNc1ncc(-c2cccc(F)c2)cc1O
InChIInChI=1S/C15H16FN3O2/c1-19(2)14(21)9-18-15-13(20)7-11(8-17-15)10-4-3-5-12(16)6-10/h3-8,20H,9H2,1-2H3,(H,17,18)
InChIKeyOBSNNDQWGFDERT-UHFFFAOYSA-N
XLogP2.09
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

CID 11500131
CID 11500131
CID 135126582
CID 135126582
CID 156273924
CID 156273924
CID 156273930
CID 156273930
CID 156273938
CID 156273938
CID 156273977
CID 156273977
CID 130200713
CID 130200713
CID 130200890
CID 130200890
CID 135137835
CID 135137835
CID 44395801
CID 44395801
CID 125142273
CID 125142273
CID 10246836
CID 10246836

Frequently Asked Questions

What is the IUPAC name of 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide (CID 68660884) is 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide is CN(C)C(=O)CNc1ncc(-c2cccc(F)c2)cc1O.
What is the InChIKey of 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide?
The InChIKey is OBSNNDQWGFDERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O2/c1-19(2)14(21)9-18-15-13(20)7-11(8-17-15)10-4-3-5-12(16)6-10/h3-8,20H,9H2,1-2H3,(H,17,18).
What are the key properties of 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide?
2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide has a molecular weight of 289.31 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]-N,N-dimethylacetamide is sourced from PubChem (CID 68660884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).