1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine

C12H17FN2 — CID 117018125

IUPAC1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine
SMILESCC1(C)CC(N)CN1c1ccccc1F
InChIInChI=1S/C12H17FN2/c1-12(2)7-9(14)8-15(12)11-6-4-3-5-10(11)13/h3-6,9H,7-8,14H2,1-2H3
InChIKeyCPEZESNASZUHFF-UHFFFAOYSA-N
MW208.28 g/mol
LogP2.14
Rot. Bonds1

About 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine

1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine (PubChem CID 117018125) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine
PubChem CID117018125
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC Name1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine
SMILESCC1(C)CC(N)CN1c1ccccc1F
InChIInChI=1S/C12H17FN2/c1-12(2)7-9(14)8-15(12)11-6-4-3-5-10(11)13/h3-6,9H,7-8,14H2,1-2H3
InChIKeyCPEZESNASZUHFF-UHFFFAOYSA-N
XLogP2.14
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-5,5-dimethylpyrrolidin-3-amine
CID 117018127
1-(2-tert-butylphenyl)-5,5-dimethylpyrrolidin-3-amine
CID 117018123
5,5-dimethyl-1-(2-propan-2-yloxyphenyl)pyrrolidin-3-amine
CID 117018146
2-[1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-yl]acetic acid
CID 117018480
1-(2-fluorophenyl)-2,2-dimethylpiperidin-3-amine
CID 117019217
1,3-bis(2-fluorophenyl)-4,4-dimethylimidazolidine
CID 129229077
1-(2-chlorophenyl)-6,6-dimethylpiperidin-3-amine
CID 117021020
2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine
CID 117020100
1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine
CID 117020121
[1-(2-tert-butylphenyl)-5,5-dimethylpyrrolidin-3-yl]methanamine
CID 117018770
1-(2-fluorophenyl)-2,2-dimethylpiperidin-3-one
CID 117019137
1-(benzenesulfonyl)-5,5-dimethylpyrrolidin-3-amine
CID 115269150

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine?
The IUPAC name of 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine (CID 117018125) is 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine?
The canonical SMILES for 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine is CC1(C)CC(N)CN1c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine?
The InChIKey is CPEZESNASZUHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2/c1-12(2)7-9(14)8-15(12)11-6-4-3-5-10(11)13/h3-6,9H,7-8,14H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine?
1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine has a molecular weight of 208.28 g/mol, XLogP of 2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-5,5-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 117018125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).