3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine

C15H24FN — CID 62723351

IUPAC3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine
SMILESCC(C)CNCC(C)(C)Cc1ccccc1F
InChIInChI=1S/C15H24FN/c1-12(2)10-17-11-15(3,4)9-13-7-5-6-8-14(13)16/h5-8,12,17H,9-11H2,1-4H3
InChIKeyKMZVMZGVSARGIS-UHFFFAOYSA-N
MW237.36 g/mol
LogP3.64
Rot. Bonds6

About 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine

3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine (PubChem CID 62723351) has the molecular formula C15H24FN and a molecular weight of 237.36 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine.

Molecular Properties

Compound Name3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine
PubChem CID62723351
Molecular FormulaC15H24FN
Molecular Weight237.36 g/mol
Exact Mass237.19
IUPAC Name3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine
SMILESCC(C)CNCC(C)(C)Cc1ccccc1F
InChIInChI=1S/C15H24FN/c1-12(2)10-17-11-15(3,4)9-13-7-5-6-8-14(13)16/h5-8,12,17H,9-11H2,1-4H3
InChIKeyKMZVMZGVSARGIS-UHFFFAOYSA-N
XLogP3.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.36
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2-fluorophenyl)-N,2,2-trimethylpropan-1-amine
CID 62724113
3-(2-fluorophenyl)-2,2-dimethylpropan-1-amine
CID 62739574
2-[(2,3-difluorophenyl)methyl]-2,3-dimethyl-N-(2-methylpropyl)butan-1-amine
CID 83151325
3-(2-fluorophenyl)-2-methyl-2-(2-methylpropylamino)propan-1-ol
CID 114834242
1-(2-chloro-3-fluorophenyl)-2-methyl-3-(2-methylpropylamino)propan-2-ol
CID 112654826
2-[(2-fluorophenyl)methyl]-3-methyl-N-(2-methylpropyl)butan-1-amine
CID 62530350
3-(2,3-difluorophenyl)-N-ethyl-2,2-dimethylpropan-1-amine
CID 62723528
2-[(2,5-difluorophenyl)methyl]-2,3-dimethyl-N-(2-methylpropyl)butan-1-amine
CID 83151781
N-[(2-fluorophenyl)methyl]-2,2-dimethylpropan-1-amine
CID 61168585
1-butan-2-yl-4-[3-(2-fluorophenyl)-2,2-dimethylpropyl]benzene
CID 129212648
3-(4-bromo-3-fluorophenoxy)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine
CID 79626121
1-(2-fluorophenyl)-2-methylpropan-2-amine;hydrochloride
CID 70701058

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine?
The IUPAC name of 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine (CID 62723351) is 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine.
What is the SMILES notation for 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine?
The canonical SMILES for 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine is CC(C)CNCC(C)(C)Cc1ccccc1F.
What is the InChIKey of 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine?
The InChIKey is KMZVMZGVSARGIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FN/c1-12(2)10-17-11-15(3,4)9-13-7-5-6-8-14(13)16/h5-8,12,17H,9-11H2,1-4H3.
What are the key properties of 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine?
3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine has a molecular weight of 237.36 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine is sourced from PubChem (CID 62723351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).