(1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine

C10H14FNO — CID 124705479

IUPAC(1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine
SMILESCCOc1ccccc1[C@@H](N)CF
InChIInChI=1S/C10H14FNO/c1-2-13-10-6-4-3-5-8(10)9(12)7-11/h3-6,9H,2,7,12H2,1H3/t9-/m0/s1
InChIKeyVWNBBRCCOJUIOM-VIFPVBQESA-N
MW183.23 g/mol
LogP2.05
Rot. Bonds4

About (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine

(1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine (PubChem CID 124705479) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine.

Molecular Properties

Compound Name(1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine
PubChem CID124705479
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name(1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine
SMILESCCOc1ccccc1[C@@H](N)CF
InChIInChI=1S/C10H14FNO/c1-2-13-10-6-4-3-5-8(10)9(12)7-11/h3-6,9H,2,7,12H2,1H3/t9-/m0/s1
InChIKeyVWNBBRCCOJUIOM-VIFPVBQESA-N
XLogP2.05
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-(2-ethoxyphenyl)propan-1-amine;hydrochloride
CID 171221746
2-[(1R)-1-amino-2-fluoroethyl]-6-ethoxyphenol;hydrochloride
CID 171235629
(1R)-1-[2-(ethoxymethoxy)phenyl]propan-1-amine
CID 65369462
(1S)-1-(2-ethoxyphenyl)-4,4,4-trifluorobutan-1-amine;hydrochloride
CID 171221760
1-(2-ethoxyphenyl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 16788139
(1S)-1-(2-ethoxyphenyl)but-3-en-1-amine
CID 171221750
1-(2-ethoxyphenyl)-3-methylpentan-1-amine
CID 115533625
1-(2-ethoxyphenyl)-N'-methyl-N'-pentan-3-ylethane-1,2-diamine
CID 43570986
N',N'-dibutyl-1-(2-ethoxyphenyl)ethane-1,2-diamine
CID 43125934
N'-cyclopentyl-1-(2-ethoxyphenyl)-N'-methylethane-1,2-diamine
CID 43267133
N'-[2-(dimethylamino)ethyl]-1-(2-ethoxyphenyl)-N'-methylethane-1,2-diamine
CID 55228302
1-(2-ethoxyphenyl)-N'-methyl-N'-(2-methylbutyl)ethane-1,2-diamine
CID 43295700

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine?
The IUPAC name of (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine (CID 124705479) is (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine.
What is the SMILES notation for (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine?
The canonical SMILES for (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine is CCOc1ccccc1[C@@H](N)CF.
What is the InChIKey of (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine?
The InChIKey is VWNBBRCCOJUIOM-VIFPVBQESA-N. The full InChI is InChI=1S/C10H14FNO/c1-2-13-10-6-4-3-5-8(10)9(12)7-11/h3-6,9H,2,7,12H2,1H3/t9-/m0/s1.
What are the key properties of (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine?
(1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine has a molecular weight of 183.23 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine is sourced from PubChem (CID 124705479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).