4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol

C10H15FN2O — CID 130561119

IUPAC4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol
SMILESCC(C)(O)CCNc1ccc(F)cn1
InChIInChI=1S/C10H15FN2O/c1-10(2,14)5-6-12-9-4-3-8(11)7-13-9/h3-4,7,14H,5-6H2,1-2H3,(H,12,13)
InChIKeyYOSRZFRYQPCUTM-UHFFFAOYSA-N
MW198.24 g/mol
LogP1.79
Rot. Bonds4

About 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol

4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol (PubChem CID 130561119) has the molecular formula C10H15FN2O and a molecular weight of 198.24 g/mol. Its IUPAC name is 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol.

Molecular Properties

Compound Name4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol
PubChem CID130561119
Molecular FormulaC10H15FN2O
Molecular Weight198.24 g/mol
Exact Mass198.12
IUPAC Name4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol
SMILESCC(C)(O)CCNc1ccc(F)cn1
InChIInChI=1S/C10H15FN2O/c1-10(2,14)5-6-12-9-4-3-8(11)7-13-9/h3-4,7,14H,5-6H2,1-2H3,(H,12,13)
InChIKeyYOSRZFRYQPCUTM-UHFFFAOYSA-N
XLogP1.79
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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

5-fluoro-N-(2-fluoroethyl)pyridin-2-amine
CID 130504146
(2S)-4-[(5-fluoro-2-pyridinyl)amino]butan-2-ol
CID 130918484
5-fluoro-N-(7-methyloctyl)pyridin-2-amine
CID 107816143
tert-butyl N-[2-[(5-fluoro-2-pyridinyl)amino]ethyl]carbamate
CID 114518182
N-(5-fluoro-2-pyridinyl)-2,2-dimethylbutane-1,4-diamine
CID 106142088
5-fluoro-N-(2-methylsulfonylethyl)pyridin-2-amine
CID 61313739
3-[(5-fluoro-2-pyridinyl)amino]-N,N-dimethylpropanamide
CID 61313740
5-fluoro-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine
CID 63827023
3-[(5-fluoro-2-pyridinyl)amino]-3-methylpentan-1-ol
CID 106171523
methyl 2-[(5-fluoro-2-pyridinyl)amino]acetate
CID 61312351
N-(5-fluoro-2-pyridinyl)-N'-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 106048487
5-fluoro-N-[2-(4-methoxyphenyl)ethyl]pyridin-2-amine
CID 61311581

Frequently Asked Questions

What is the IUPAC name of 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol?
The IUPAC name of 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol (CID 130561119) is 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol.
What is the SMILES notation for 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol?
The canonical SMILES for 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol is CC(C)(O)CCNc1ccc(F)cn1.
What is the InChIKey of 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol?
The InChIKey is YOSRZFRYQPCUTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2O/c1-10(2,14)5-6-12-9-4-3-8(11)7-13-9/h3-4,7,14H,5-6H2,1-2H3,(H,12,13).
What are the key properties of 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol?
4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol has a molecular weight of 198.24 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol is sourced from PubChem (CID 130561119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).