2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine

C14H16FNO — CID 64770505

IUPAC2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine
SMILESCC(C)(c1ccc(F)cc1)C(N)c1ccco1
InChIInChI=1S/C14H16FNO/c1-14(2,10-5-7-11(15)8-6-10)13(16)12-4-3-9-17-12/h3-9,13H,16H2,1-2H3
InChIKeyFUSVWNRGFVLAKK-UHFFFAOYSA-N
MW233.29 g/mol
LogP3.40
Rot. Bonds3

About 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine

2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine (PubChem CID 64770505) has the molecular formula C14H16FNO and a molecular weight of 233.29 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine
PubChem CID64770505
Molecular FormulaC14H16FNO
Molecular Weight233.29 g/mol
Exact Mass233.12
IUPAC Name2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine
SMILESCC(C)(c1ccc(F)cc1)C(N)c1ccco1
InChIInChI=1S/C14H16FNO/c1-14(2,10-5-7-11(15)8-6-10)13(16)12-4-3-9-17-12/h3-9,13H,16H2,1-2H3
InChIKeyFUSVWNRGFVLAKK-UHFFFAOYSA-N
XLogP3.40
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-2,2,2-trifluoro-1-(furan-2-yl)ethanamine;hydrochloride
CID 131879129
3-amino-3-(furan-2-yl)-2,2-dimethylpropan-1-ol
CID 130059387
1-(furan-2-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 79053383
2-(4-fluorophenyl)-2-methyl-1-(3-methylphenyl)propan-1-amine
CID 64769920
1-(2,3-dimethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-amine
CID 64768356
(3S)-3-amino-3-(furan-2-yl)-2,2-dimethylpropanoic acid
CID 55292739
(3S)-3-amino-2,2-difluoro-3-(furan-2-yl)propan-1-ol
CID 130700545
2-(4-fluorophenyl)-2-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine
CID 64770702
1-(5-fluoro-1-benzofuran-2-yl)-2-methyl-2-phenylpropan-1-amine
CID 114728507
2-(4-fluorophenyl)-2,4-dimethylheptan-3-amine
CID 114013785
N-[(4-fluorophenyl)methyl]-1-(furan-2-yl)ethanamine
CID 43178684
2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-one
CID 64757945

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine?
The IUPAC name of 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine (CID 64770505) is 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine?
The canonical SMILES for 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine is CC(C)(c1ccc(F)cc1)C(N)c1ccco1.
What is the InChIKey of 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine?
The InChIKey is FUSVWNRGFVLAKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNO/c1-14(2,10-5-7-11(15)8-6-10)13(16)12-4-3-9-17-12/h3-9,13H,16H2,1-2H3.
What are the key properties of 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine?
2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine has a molecular weight of 233.29 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(furan-2-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 64770505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).