N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide

C10H12FNO — CID 81366934

IUPACN-[(1R)-1-(3-fluorophenyl)ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1cccc(F)c1
InChIInChI=1S/C10H12FNO/c1-7(12-8(2)13)9-4-3-5-10(11)6-9/h3-7H,1-2H3,(H,12,13)/t7-/m1/s1
InChIKeyUWBWRBZNEHMJOG-SSDOTTSWSA-N
MW181.21 g/mol
LogP2.02
Rot. Bonds2

About N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide

N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide (PubChem CID 81366934) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[(1R)-1-(3-fluorophenyl)ethyl]acetamide
PubChem CID81366934
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC NameN-[(1R)-1-(3-fluorophenyl)ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1cccc(F)c1
InChIInChI=1S/C10H12FNO/c1-7(12-8(2)13)9-4-3-5-10(11)6-9/h3-7H,1-2H3,(H,12,13)/t7-/m1/s1
InChIKeyUWBWRBZNEHMJOG-SSDOTTSWSA-N
XLogP2.02
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[1-(3-fluorophenyl)ethyl]-3-propan-2-ylurea
CID 47015065
(2R)-2-amino-N-[(1R)-1-(3-fluorophenyl)ethyl]propanamide
CID 81364932
2-amino-N-[(1R)-1-(3-fluorophenyl)ethyl]propanamide
CID 81365596
2-chloro-N-[(1S)-1-(3-fluorophenyl)ethyl]propanamide
CID 81365342
2-bromo-N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide
CID 81365784
2-amino-N-[1-(3-fluorophenyl)ethyl]-3,3-dimethylbutanamide
CID 76897375
2-acetamido-3-[[(1R)-1-(3-fluorophenyl)ethyl]amino]propanoic acid
CID 81365356
N-[(1S)-1-(3-fluorophenyl)ethyl]butanamide
CID 81366054
(2R)-2-[1-(3-fluorophenyl)ethylcarbamoylamino]propanoic acid
CID 78972642
N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide
CID 60630491
N-[(1S)-1-(3-fluorophenyl)ethyl]-2-methyl-3-(methylamino)propanamide
CID 81365967
tert-butyl N-[1-(3-fluorophenyl)ethyl]carbamate
CID 63787966

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide?
The IUPAC name of N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide (CID 81366934) is N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide?
The canonical SMILES for N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide is CC(=O)N[C@H](C)c1cccc(F)c1.
What is the InChIKey of N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide?
The InChIKey is UWBWRBZNEHMJOG-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H12FNO/c1-7(12-8(2)13)9-4-3-5-10(11)6-9/h3-7H,1-2H3,(H,12,13)/t7-/m1/s1.
What are the key properties of N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide?
N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide has a molecular weight of 181.21 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 81366934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).