1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine

C17H26FN — CID 114830149

IUPAC1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine
SMILESCC(Cc1ccccc1F)NCC1C(C)(C)C1(C)C
InChIInChI=1S/C17H26FN/c1-12(10-13-8-6-7-9-14(13)18)19-11-15-16(2,3)17(15,4)5/h6-9,12,15,19H,10-11H2,1-5H3
InChIKeyGPYRYHBSVFWQEJ-UHFFFAOYSA-N
MW263.40 g/mol
LogP4.03
Rot. Bonds5

About 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine

1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine (PubChem CID 114830149) has the molecular formula C17H26FN and a molecular weight of 263.40 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine
PubChem CID114830149
Molecular FormulaC17H26FN
Molecular Weight263.40 g/mol
Exact Mass263.20
IUPAC Name1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine
SMILESCC(Cc1ccccc1F)NCC1C(C)(C)C1(C)C
InChIInChI=1S/C17H26FN/c1-12(10-13-8-6-7-9-14(13)18)19-11-15-16(2,3)17(15,4)5/h6-9,12,15,19H,10-11H2,1-5H3
InChIKeyGPYRYHBSVFWQEJ-UHFFFAOYSA-N
XLogP4.03
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.40
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(cyclopropylmethyl)-1-(2-fluorophenyl)propan-2-amine
CID 115607332
N-(cyclohex-3-en-1-ylmethyl)-1-(2-fluorophenyl)propan-2-amine
CID 113226908
1-(2-fluorophenyl)-N-prop-2-enylpropan-2-amine
CID 114827813
1-(2-fluorophenyl)-N-(3-phenylpropyl)propan-2-amine
CID 115592301
1-(2-fluorophenyl)-N-[(1-methylpiperidin-3-yl)methyl]propan-2-amine
CID 114829632
3-[[1-(2-fluorophenyl)propan-2-ylamino]methyl]cyclohexan-1-ol
CID 102612821
3-[1-(2-fluorophenyl)propan-2-ylamino]propanenitrile
CID 115591783
N-[3-[1-(2-fluorophenyl)propan-2-ylamino]propyl]methanesulfonamide
CID 102612376
1-(2-fluorophenyl)-N-(2-methylsulfinylpropyl)propan-2-amine
CID 114830845
N-[1-(2-fluorophenyl)propan-2-yl]-2-methoxy-2-methylpropan-1-amine
CID 114830797
N-[1-(2-fluorophenyl)propan-2-yl]pent-3-yn-1-amine
CID 114830878
1-(2-fluorophenyl)-N-(2-phenoxyethyl)propan-2-amine
CID 114829606

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine?
The IUPAC name of 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine (CID 114830149) is 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine?
The canonical SMILES for 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine is CC(Cc1ccccc1F)NCC1C(C)(C)C1(C)C.
What is the InChIKey of 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine?
The InChIKey is GPYRYHBSVFWQEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FN/c1-12(10-13-8-6-7-9-14(13)18)19-11-15-16(2,3)17(15,4)5/h6-9,12,15,19H,10-11H2,1-5H3.
What are the key properties of 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine?
1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine has a molecular weight of 263.40 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]propan-2-amine is sourced from PubChem (CID 114830149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).