3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol

C10H15FN2O — CID 130892998

IUPAC3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol
SMILESCC(Nc1ncccc1F)C(C)(C)O
InChIInChI=1S/C10H15FN2O/c1-7(10(2,3)14)13-9-8(11)5-4-6-12-9/h4-7,14H,1-3H3,(H,12,13)
InChIKeyUESFIFPMOYLRNG-UHFFFAOYSA-N
MW198.24 g/mol
LogP1.79
Rot. Bonds3

About 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol

3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol (PubChem CID 130892998) has the molecular formula C10H15FN2O and a molecular weight of 198.24 g/mol. Its IUPAC name is 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol.

Molecular Properties

Compound Name3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol
PubChem CID130892998
Molecular FormulaC10H15FN2O
Molecular Weight198.24 g/mol
Exact Mass198.12
IUPAC Name3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol
SMILESCC(Nc1ncccc1F)C(C)(C)O
InChIInChI=1S/C10H15FN2O/c1-7(10(2,3)14)13-9-8(11)5-4-6-12-9/h4-7,14H,1-3H3,(H,12,13)
InChIKeyUESFIFPMOYLRNG-UHFFFAOYSA-N
XLogP1.79
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.24
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-propan-2-ylpyridin-2-amine
CID 62733783
3-[(3-chloropyrazin-2-yl)amino]-2-methylbutan-2-ol
CID 131010704
N-(3,3-dimethylbutan-2-yl)-3-(trifluoromethyl)pyridin-2-amine
CID 104828787
3-[(2-chloro-3-pyridinyl)amino]-2-methylbutan-2-ol
CID 65338181
3-fluoro-N-(6-methylheptan-2-yl)pyridin-2-amine
CID 62732858
2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide
CID 62733234
1-(dimethylamino)-3-[(3-fluoro-2-pyridinyl)amino]-2-methylpropan-2-ol
CID 103837833
2-[(3-fluoro-2-pyridinyl)amino]-1-piperidin-1-ylpropan-1-one
CID 112551708
2-methyl-3-[(2-pyrrolidin-1-yl-3-pyridinyl)amino]butan-2-ol
CID 65338174
N-(1-ethoxy-3-methylbutan-2-yl)-3-fluoropyridin-2-amine
CID 103270021
3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine
CID 126794017
3-[(3-fluoro-2-pyridinyl)amino]-2-methylpropanenitrile
CID 131201275

Frequently Asked Questions

What is the IUPAC name of 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol?
The IUPAC name of 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol (CID 130892998) is 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol.
What is the SMILES notation for 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol?
The canonical SMILES for 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol is CC(Nc1ncccc1F)C(C)(C)O.
What is the InChIKey of 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol?
The InChIKey is UESFIFPMOYLRNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2O/c1-7(10(2,3)14)13-9-8(11)5-4-6-12-9/h4-7,14H,1-3H3,(H,12,13).
What are the key properties of 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol?
3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol has a molecular weight of 198.24 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol is sourced from PubChem (CID 130892998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).