ethane;(4-fluorophenyl)methanamine

C11H20FN — CID 142071105

IUPACethane;(4-fluorophenyl)methanamine
SMILESCC.CC.NCc1ccc(F)cc1
InChIInChI=1S/C7H8FN.2C2H6/c8-7-3-1-6(5-9)2-4-7;2*1-2/h1-4H,5,9H2;2*1-2H3
InChIKeyJPDZUWFFEMNFFE-UHFFFAOYSA-N
MW185.29 g/mol
LogP3.34
Rot. Bonds1

About ethane;(4-fluorophenyl)methanamine

ethane;(4-fluorophenyl)methanamine (PubChem CID 142071105) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is ethane;(4-fluorophenyl)methanamine.

Molecular Properties

Compound Nameethane;(4-fluorophenyl)methanamine
PubChem CID142071105
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC Nameethane;(4-fluorophenyl)methanamine
SMILESCC.CC.NCc1ccc(F)cc1
InChIInChI=1S/C7H8FN.2C2H6/c8-7-3-1-6(5-9)2-4-7;2*1-2/h1-4H,5,9H2;2*1-2H3
InChIKeyJPDZUWFFEMNFFE-UHFFFAOYSA-N
XLogP3.34
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride
CID 10308088
1-[4-(aminomethyl)phenyl]-1-(4-fluorophenyl)-N,N-dimethylmethanamine
CID 116907154
cyclopentanamine;(4-fluorophenyl)methanamine
CID 70105536
[4-(5-fluoro-2-methylphenyl)phenyl]methanamine
CID 61026392
N-[[4-(aminomethyl)phenyl]methyl]-4-fluoro-N-methylbenzenesulfonamide
CID 60923004
[4-(bromomethyl)phenyl]methanamine
CID 24721042
N'-[(4-fluorophenyl)methyl]-N'-methylmethanediamine
CID 115225832
1-[4-(aminomethyl)phenyl]-2-[(4-fluorophenyl)methyl-methylamino]ethanol
CID 43575790
[4-(aminomethyl)phenyl]-[4-(4-fluorobenzoyl)piperazin-1-yl]methanone
CID 119281929
[6-[[(4-fluorophenyl)methyl-methylamino]methyl]-2-pyridinyl]methanamine
CID 106905327
N-[3-[4-(aminomethyl)phenyl]propyl]-1-(4-fluorophenyl)propan-2-amine
CID 165377968
ethane;phenylmethanamine;vanadium
CID 158602574

Frequently Asked Questions

What is the IUPAC name of ethane;(4-fluorophenyl)methanamine?
The IUPAC name of ethane;(4-fluorophenyl)methanamine (CID 142071105) is ethane;(4-fluorophenyl)methanamine.
What is the SMILES notation for ethane;(4-fluorophenyl)methanamine?
The canonical SMILES for ethane;(4-fluorophenyl)methanamine is CC.CC.NCc1ccc(F)cc1.
What is the InChIKey of ethane;(4-fluorophenyl)methanamine?
The InChIKey is JPDZUWFFEMNFFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FN.2C2H6/c8-7-3-1-6(5-9)2-4-7;2*1-2/h1-4H,5,9H2;2*1-2H3.
What are the key properties of ethane;(4-fluorophenyl)methanamine?
ethane;(4-fluorophenyl)methanamine has a molecular weight of 185.29 g/mol, XLogP of 3.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(4-fluorophenyl)methanamine is sourced from PubChem (CID 142071105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).