3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol

C8H18FNO — CID 103993444

IUPAC3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol
SMILESCC(C)(O)C(C)(C)NCCF
InChIInChI=1S/C8H18FNO/c1-7(2,8(3,4)11)10-6-5-9/h10-11H,5-6H2,1-4H3
InChIKeyNESPKABADOHJIF-UHFFFAOYSA-N
MW163.24 g/mol
LogP1.10
Rot. Bonds4

About 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol

3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol (PubChem CID 103993444) has the molecular formula C8H18FNO and a molecular weight of 163.24 g/mol. Its IUPAC name is 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol.

Molecular Properties

Compound Name3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol
PubChem CID103993444
Molecular FormulaC8H18FNO
Molecular Weight163.24 g/mol
Exact Mass163.14
IUPAC Name3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol
SMILESCC(C)(O)C(C)(C)NCCF
InChIInChI=1S/C8H18FNO/c1-7(2,8(3,4)11)10-6-5-9/h10-11H,5-6H2,1-4H3
InChIKeyNESPKABADOHJIF-UHFFFAOYSA-N
XLogP1.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-Dimethyl-3-(methylamino)-2-butanol
CID 14042308
1-[(1,1-Dimethylethyl)amino]-2-methyl-2-propanol
CID 10909698
(3R)-4-(tert-butylamino)-3-fluoro-2-methylbutan-2-ol
CID 117797864
2-Methyl-1-(3,3,3-trifluoropropylamino)butan-2-ol
CID 65111139
2-Methyl-3-(3,3,3-trifluoropropylamino)butan-2-ol
CID 65337529
3-(Tert-butylamino)-1,1,1-trifluoro-2-methylpropan-2-ol
CID 80559064
3-(Tert-butylamino)-1,1-difluoro-2-methylpropan-2-ol
CID 80605073
1-(2-Fluoroethylamino)-2-methylbutan-2-ol
CID 80694203
3-[(2-Fluoroethylamino)methyl]pentan-3-ol
CID 80694204
1-(3-Fluoropropylamino)-2-methylpropan-2-ol
CID 81107198
1-(3-Fluoropropylamino)-2-methylbutan-2-ol
CID 81107199
3-[(3-Fluoropropylamino)methyl]pentan-3-ol
CID 81107321

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol?
The IUPAC name of 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol (CID 103993444) is 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol.
What is the SMILES notation for 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol?
The canonical SMILES for 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol is CC(C)(O)C(C)(C)NCCF.
What is the InChIKey of 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol?
The InChIKey is NESPKABADOHJIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18FNO/c1-7(2,8(3,4)11)10-6-5-9/h10-11H,5-6H2,1-4H3.
What are the key properties of 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol?
3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol has a molecular weight of 163.24 g/mol, XLogP of 1.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethylamino)-2,3-dimethylbutan-2-ol is sourced from PubChem (CID 103993444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).