3-(2-fluoroethylamino)-3-methylpentan-1-ol

C8H18FNO — CID 106175063

IUPAC3-(2-fluoroethylamino)-3-methylpentan-1-ol
SMILESCCC(C)(CCO)NCCF
InChIInChI=1S/C8H18FNO/c1-3-8(2,4-7-11)10-6-5-9/h10-11H,3-7H2,1-2H3
InChIKeyRNTMNRBCJNGOAH-UHFFFAOYSA-N
MW163.24 g/mol
LogP1.10
Rot. Bonds6

About 3-(2-fluoroethylamino)-3-methylpentan-1-ol

3-(2-fluoroethylamino)-3-methylpentan-1-ol (PubChem CID 106175063) has the molecular formula C8H18FNO and a molecular weight of 163.24 g/mol. Its IUPAC name is 3-(2-fluoroethylamino)-3-methylpentan-1-ol.

Molecular Properties

Compound Name3-(2-fluoroethylamino)-3-methylpentan-1-ol
PubChem CID106175063
Molecular FormulaC8H18FNO
Molecular Weight163.24 g/mol
Exact Mass163.14
IUPAC Name3-(2-fluoroethylamino)-3-methylpentan-1-ol
SMILESCCC(C)(CCO)NCCF
InChIInChI=1S/C8H18FNO/c1-3-8(2,4-7-11)10-6-5-9/h10-11H,3-7H2,1-2H3
InChIKeyRNTMNRBCJNGOAH-UHFFFAOYSA-N
XLogP1.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
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

(2R)-3-(tert-butylamino)-2-fluoropropan-1-ol
CID 117797863
3-(Tert-butylamino)-2-fluoropropan-1-ol
CID 166004695
4-(Tert-butylamino)-2-fluorobutan-1-ol
CID 166969767
2-Ethyl-2-(2,2,2-trifluoroethylamino)butan-1-ol
CID 61047491
2-(2,2-Difluoroethylamino)-2-ethylbutan-1-ol
CID 62518519
2-Ethyl-2-(3,3,3-trifluoropropylamino)butan-1-ol
CID 64555211
2-Ethyl-2-(2-fluoroethylamino)butan-1-ol
CID 80694043
3-[(2-Fluoroethylamino)methyl]pentan-1-ol
CID 80694218
2-(2-Fluoroethylamino)-2-methylbutan-1-ol
CID 80695338
3-[(3-Fluoropropylamino)methyl]pentan-1-ol
CID 81105917
2-(3-Fluoropropylamino)-2-methylbutan-1-ol
CID 81106080
2-Ethyl-2-(3-fluoropropylamino)butan-1-ol
CID 81106337

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethylamino)-3-methylpentan-1-ol?
The IUPAC name of 3-(2-fluoroethylamino)-3-methylpentan-1-ol (CID 106175063) is 3-(2-fluoroethylamino)-3-methylpentan-1-ol.
What is the SMILES notation for 3-(2-fluoroethylamino)-3-methylpentan-1-ol?
The canonical SMILES for 3-(2-fluoroethylamino)-3-methylpentan-1-ol is CCC(C)(CCO)NCCF.
What is the InChIKey of 3-(2-fluoroethylamino)-3-methylpentan-1-ol?
The InChIKey is RNTMNRBCJNGOAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18FNO/c1-3-8(2,4-7-11)10-6-5-9/h10-11H,3-7H2,1-2H3.
What are the key properties of 3-(2-fluoroethylamino)-3-methylpentan-1-ol?
3-(2-fluoroethylamino)-3-methylpentan-1-ol has a molecular weight of 163.24 g/mol, XLogP of 1.10, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethylamino)-3-methylpentan-1-ol is sourced from PubChem (CID 106175063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).