N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide

C12H15FN2O — CID 110460355

IUPACN-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C12H15FN2O/c1-14-8-11(16)15-12(6-7-12)9-2-4-10(13)5-3-9/h2-5,14H,6-8H2,1H3,(H,15,16)
InChIKeySFUMPVNJWFGQLI-UHFFFAOYSA-N
MW222.26 g/mol
LogP1.15
Rot. Bonds4

About N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide

N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide (PubChem CID 110460355) has the molecular formula C12H15FN2O and a molecular weight of 222.26 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide
PubChem CID110460355
Molecular FormulaC12H15FN2O
Molecular Weight222.26 g/mol
Exact Mass222.12
IUPAC NameN-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C12H15FN2O/c1-14-8-11(16)15-12(6-7-12)9-2-4-10(13)5-3-9/h2-5,14H,6-8H2,1H3,(H,15,16)
InChIKeySFUMPVNJWFGQLI-UHFFFAOYSA-N
XLogP1.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-fluorophenyl)cyclopropyl]-3-methylbutanamide
CID 71684215
N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide
CID 119764374
N-[1-(4-fluorophenyl)cyclopentyl]-3-oxobutanamide
CID 110477392
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 119731211
N-[1-(4-fluorophenyl)cyclopropyl]-2,2-dimethylpropanamide
CID 110444694
2-amino-N-[1-(4-fluorophenyl)cyclopentyl]acetamide;hydrochloride
CID 119305589
N-[1-(4-fluorophenyl)cyclopentyl]-2-methyl-3-(methylamino)propanamide
CID 119752714
N-[1-(4-fluorophenyl)cyclopentyl]acetamide
CID 71936960
(2R)-2-amino-N-[1-(4-fluorophenyl)cyclopropyl]propanamide
CID 119318315
(E)-N-[1-(4-fluorophenyl)cyclopropyl]but-2-enamide
CID 110478088
N-[1-(4-fluorophenyl)cyclopropyl]but-2-enamide
CID 91550957
2-chloro-N-[4-(4-fluorophenyl)oxan-4-yl]acetamide
CID 166403727

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide?
The IUPAC name of N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide (CID 110460355) is N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide?
The canonical SMILES for N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide is CNCC(=O)NC1(c2ccc(F)cc2)CC1.
What is the InChIKey of N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide?
The InChIKey is SFUMPVNJWFGQLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O/c1-14-8-11(16)15-12(6-7-12)9-2-4-10(13)5-3-9/h2-5,14H,6-8H2,1H3,(H,15,16).
What are the key properties of N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide?
N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide has a molecular weight of 222.26 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide is sourced from PubChem (CID 110460355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).