2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine

C10H22FNO — CID 134581779

IUPAC2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine
SMILESCC(C)NCC(C)(F)COC(C)C
InChIInChI=1S/C10H22FNO/c1-8(2)12-6-10(5,11)7-13-9(3)4/h8-9,12H,6-7H2,1-5H3
InChIKeyDLMHXZNIXPWKGV-UHFFFAOYSA-N
MW191.29 g/mol
LogP2.14
Rot. Bonds6

About 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine

2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine (PubChem CID 134581779) has the molecular formula C10H22FNO and a molecular weight of 191.29 g/mol. Its IUPAC name is 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine.

Molecular Properties

Compound Name2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine
PubChem CID134581779
Molecular FormulaC10H22FNO
Molecular Weight191.29 g/mol
Exact Mass191.17
IUPAC Name2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine
SMILESCC(C)NCC(C)(F)COC(C)C
InChIInChI=1S/C10H22FNO/c1-8(2)12-6-10(5,11)7-13-9(3)4/h8-9,12H,6-7H2,1-5H3
InChIKeyDLMHXZNIXPWKGV-UHFFFAOYSA-N
XLogP2.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
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 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine?
The IUPAC name of 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine (CID 134581779) is 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine.
What is the SMILES notation for 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine?
The canonical SMILES for 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine is CC(C)NCC(C)(F)COC(C)C.
What is the InChIKey of 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine?
The InChIKey is DLMHXZNIXPWKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22FNO/c1-8(2)12-6-10(5,11)7-13-9(3)4/h8-9,12H,6-7H2,1-5H3.
What are the key properties of 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine?
2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine has a molecular weight of 191.29 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine is sourced from PubChem (CID 134581779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).