N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine

C10H22FNO — CID 107446561

IUPACN-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine
SMILESCC(C)OCC(F)CNC(C)(C)C
InChIInChI=1S/C10H22FNO/c1-8(2)13-7-9(11)6-12-10(3,4)5/h8-9,12H,6-7H2,1-5H3
InChIKeyLAJAHODWLUFXOP-UHFFFAOYSA-N
MW191.29 g/mol
LogP2.14
Rot. Bonds5

About N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine

N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine (PubChem CID 107446561) has the molecular formula C10H22FNO and a molecular weight of 191.29 g/mol. Its IUPAC name is N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine
PubChem CID107446561
Molecular FormulaC10H22FNO
Molecular Weight191.29 g/mol
Exact Mass191.17
IUPAC NameN-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine
SMILESCC(C)OCC(F)CNC(C)(C)C
InChIInChI=1S/C10H22FNO/c1-8(2)13-7-9(11)6-12-10(3,4)5/h8-9,12H,6-7H2,1-5H3
InChIKeyLAJAHODWLUFXOP-UHFFFAOYSA-N
XLogP2.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.29
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine?
The IUPAC name of N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine (CID 107446561) is N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine.
What is the SMILES notation for N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine?
The canonical SMILES for N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine is CC(C)OCC(F)CNC(C)(C)C.
What is the InChIKey of N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine?
The InChIKey is LAJAHODWLUFXOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22FNO/c1-8(2)13-7-9(11)6-12-10(3,4)5/h8-9,12H,6-7H2,1-5H3.
What are the key properties of N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine?
N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine has a molecular weight of 191.29 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-3-propan-2-yloxypropyl)-2-methylpropan-2-amine is sourced from PubChem (CID 107446561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).