(1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine

C10H14FN — CID 93312415

IUPAC(1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine
SMILESCC[C@@H](NC)c1cccc(F)c1
InChIInChI=1S/C10H14FN/c1-3-10(12-2)8-5-4-6-9(11)7-8/h4-7,10,12H,3H2,1-2H3/t10-/m1/s1
InChIKeyXBIWSEHUOQREKW-SNVBAGLBSA-N
MW167.23 g/mol
LogP2.50
Rot. Bonds3

About (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine

(1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine (PubChem CID 93312415) has the molecular formula C10H14FN and a molecular weight of 167.23 g/mol. Its IUPAC name is (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name(1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine
PubChem CID93312415
Molecular FormulaC10H14FN
Molecular Weight167.23 g/mol
Exact Mass167.11
IUPAC Name(1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine
SMILESCC[C@@H](NC)c1cccc(F)c1
InChIInChI=1S/C10H14FN/c1-3-10(12-2)8-5-4-6-9(11)7-8/h4-7,10,12H,3H2,1-2H3/t10-/m1/s1
InChIKeyXBIWSEHUOQREKW-SNVBAGLBSA-N
XLogP2.50
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.23
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-fluorophenyl)-N,3-dimethylpentan-1-amine
CID 62607548
2-butan-2-ylsulfanyl-1-(3-fluorophenyl)-N-methylethanamine
CID 65136489
2-[1-(3-fluorophenyl)propyl]-1,1-dimethylhydrazine
CID 114871774
1-(3-fluorophenyl)-N-methylheptan-1-amine
CID 62607373
1-[3-(2,4-difluorophenyl)phenyl]-N-methylpropan-1-amine
CID 61033126
N-ethoxy-1-(3-fluorophenyl)propan-1-amine
CID 114871757
1-(3-fluorophenyl)-N-methyl-N'-propan-2-ylethane-1,2-diamine
CID 116950529
1-(3-fluorophenyl)-N,N',N'-trimethylpropane-1,3-diamine
CID 62644803
N-[1-(3-fluorophenyl)propyl]but-2-yn-1-amine
CID 114871834
1-(3-fluorophenyl)-2-(3-fluorophenyl)sulfanyl-N-methylethanamine
CID 66072488
N-methyl-3-[1-(methylamino)propyl]aniline
CID 116951935
3-(3-fluorophenyl)-N-methylpentan-2-amine
CID 114873130

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine?
The IUPAC name of (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine (CID 93312415) is (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine.
What is the SMILES notation for (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine?
The canonical SMILES for (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine is CC[C@@H](NC)c1cccc(F)c1.
What is the InChIKey of (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine?
The InChIKey is XBIWSEHUOQREKW-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H14FN/c1-3-10(12-2)8-5-4-6-9(11)7-8/h4-7,10,12H,3H2,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine?
(1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine has a molecular weight of 167.23 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 93312415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).