3-[(2-fluorophenyl)methyl-methylamino]propanamide

C11H15FN2O — CID 60647903

IUPAC3-[(2-fluorophenyl)methyl-methylamino]propanamide
SMILESCN(CCC(N)=O)Cc1ccccc1F
InChIInChI=1S/C11H15FN2O/c1-14(7-6-11(13)15)8-9-4-2-3-5-10(9)12/h2-5H,6-8H2,1H3,(H2,13,15)
InChIKeyUXGLZLAKOKIYCD-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.13
Rot. Bonds5

About 3-[(2-fluorophenyl)methyl-methylamino]propanamide

3-[(2-fluorophenyl)methyl-methylamino]propanamide (PubChem CID 60647903) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)methyl-methylamino]propanamide.

Molecular Properties

Compound Name3-[(2-fluorophenyl)methyl-methylamino]propanamide
PubChem CID60647903
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name3-[(2-fluorophenyl)methyl-methylamino]propanamide
SMILESCN(CCC(N)=O)Cc1ccccc1F
InChIInChI=1S/C11H15FN2O/c1-14(7-6-11(13)15)8-9-4-2-3-5-10(9)12/h2-5H,6-8H2,1H3,(H2,13,15)
InChIKeyUXGLZLAKOKIYCD-UHFFFAOYSA-N
XLogP1.13
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-3-sulfanylidenepropyl)-3-[(2-fluorophenyl)methyl-methylamino]-N-methylpropanamide
CID 61412837
3-[(2-fluorophenyl)methyl-methylamino]propan-1-ol
CID 60674294
3-[(2-methoxyphenyl)methyl-methylamino]propanamide
CID 27095531
N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide
CID 24588973
4-[(2-fluorophenyl)methyl-methylamino]-1-phenylbutan-1-one
CID 60692532
N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine
CID 43374430
3-chloro-N-[(2-fluorophenyl)methyl]-N-methylpropan-1-amine
CID 61412579
N',N'-diethyl-N-[(2-fluorophenyl)methyl]-N-methylethane-1,2-diamine
CID 783899
2-[(2-fluorophenyl)methyl-methylamino]-N'-hydroxyethanimidamide
CID 76873732
5-[(2-fluorophenyl)methyl-methylamino]-2,2-dimethylpentanethioamide
CID 65259633
(2-fluorophenyl)methyl-methylcarbamic acid
CID 115171049
2-amino-1-[(2-fluorophenyl)methyl]-1-methylguanidine
CID 77053904

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)methyl-methylamino]propanamide?
The IUPAC name of 3-[(2-fluorophenyl)methyl-methylamino]propanamide (CID 60647903) is 3-[(2-fluorophenyl)methyl-methylamino]propanamide.
What is the SMILES notation for 3-[(2-fluorophenyl)methyl-methylamino]propanamide?
The canonical SMILES for 3-[(2-fluorophenyl)methyl-methylamino]propanamide is CN(CCC(N)=O)Cc1ccccc1F.
What is the InChIKey of 3-[(2-fluorophenyl)methyl-methylamino]propanamide?
The InChIKey is UXGLZLAKOKIYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-14(7-6-11(13)15)8-9-4-2-3-5-10(9)12/h2-5H,6-8H2,1H3,(H2,13,15).
What are the key properties of 3-[(2-fluorophenyl)methyl-methylamino]propanamide?
3-[(2-fluorophenyl)methyl-methylamino]propanamide has a molecular weight of 210.25 g/mol, XLogP of 1.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)methyl-methylamino]propanamide is sourced from PubChem (CID 60647903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).