N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide

C12H17FN2O — CID 110460359

IUPACN-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide
SMILESCNCC(=O)NC(C)(C)c1ccccc1F
InChIInChI=1S/C12H17FN2O/c1-12(2,15-11(16)8-14-3)9-6-4-5-7-10(9)13/h4-7,14H,8H2,1-3H3,(H,15,16)
InChIKeyHMDNWOPWRDYKAR-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.40
Rot. Bonds4

About N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide

N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide (PubChem CID 110460359) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide
PubChem CID110460359
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC NameN-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide
SMILESCNCC(=O)NC(C)(C)c1ccccc1F
InChIInChI=1S/C12H17FN2O/c1-12(2,15-11(16)8-14-3)9-6-4-5-7-10(9)13/h4-7,14H,8H2,1-3H3,(H,15,16)
InChIKeyHMDNWOPWRDYKAR-UHFFFAOYSA-N
XLogP1.40
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-fluorophenyl)propan-2-yl]-2-pyridin-4-ylacetamide
CID 110468157
N-[2-(2-fluorophenyl)propan-2-yl]-2-(2-methoxyphenyl)acetamide
CID 110446497
N-[2-(2-fluorophenyl)propan-2-yl]-2-methylpropanamide
CID 110441926
2-chloro-N-[2-(2-fluorophenyl)propan-2-yl]benzamide
CID 110441991
2-[[2-(2-fluorophenyl)-2-methylpropyl]amino]acetic acid
CID 115218193
N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide
CID 110443410
3-fluoro-N-[2-(2-fluorophenyl)propan-2-yl]pyridine-2-carboxamide
CID 110474902
N-[2-(2-fluorophenyl)propan-2-yl]pyridine-2-carboxamide
CID 110444346
2-(2-fluorophenyl)-1-(methylamino)propan-2-ol
CID 62774362
2-(2-fluorophenyl)-N,2-dimethylpropanamide
CID 168736996
2-[[2-(methylamino)acetyl]amino]-2-phenylpropanoic acid
CID 55078720
1-[2-(2-fluorophenyl)propan-2-yl]-3-(1H-pyrrol-2-ylmethyl)urea
CID 110469820

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide?
The IUPAC name of N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide (CID 110460359) is N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide?
The canonical SMILES for N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide is CNCC(=O)NC(C)(C)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide?
The InChIKey is HMDNWOPWRDYKAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-12(2,15-11(16)8-14-3)9-6-4-5-7-10(9)13/h4-7,14H,8H2,1-3H3,(H,15,16).
What are the key properties of N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide?
N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide has a molecular weight of 224.28 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)propan-2-yl]-2-(methylamino)acetamide is sourced from PubChem (CID 110460359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).