N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide

C12H14FNO — CID 115745650

IUPACN-cyclopropyl-4-fluoro-N,2-dimethylbenzamide
SMILESCc1cc(F)ccc1C(=O)N(C)C1CC1
InChIInChI=1S/C12H14FNO/c1-8-7-9(13)3-6-11(8)12(15)14(2)10-4-5-10/h3,6-7,10H,4-5H2,1-2H3
InChIKeyGZFGDXBZXOXLRJ-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.37
Rot. Bonds2

About N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide

N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide (PubChem CID 115745650) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-fluoro-N,2-dimethylbenzamide
PubChem CID115745650
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC NameN-cyclopropyl-4-fluoro-N,2-dimethylbenzamide
SMILESCc1cc(F)ccc1C(=O)N(C)C1CC1
InChIInChI=1S/C12H14FNO/c1-8-7-9(13)3-6-11(8)12(15)14(2)10-4-5-10/h3,6-7,10H,4-5H2,1-2H3
InChIKeyGZFGDXBZXOXLRJ-UHFFFAOYSA-N
XLogP2.37
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclobutyl-4-fluoro-N,2-dimethylbenzamide
CID 115745905
N-cycloheptyl-4-fluoro-N,2-dimethylbenzamide
CID 113268593
4-fluoro-N,2-dimethyl-N-(3-methylcyclohexyl)benzamide
CID 112702414
N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide
CID 103863729
N-[(3aR,6aS)-5-(dimethylamino)-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]-4-fluoro-N,2-dimethylbenzamide
CID 134704150
3-[(4-fluoro-2-methylbenzoyl)-methylamino]cyclobutane-1-carboxylic acid
CID 154763620
4-fluoro-N,N,2-trimethylbenzamide
CID 115745346
4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide
CID 102631843
4-fluoro-N,2-dimethyl-N-(2-methyloxolan-3-yl)benzamide
CID 113399934
N-[2-[cyclopropyl(methyl)amino]ethyl]-4-fluoro-2-methylbenzamide
CID 112702550
N-(2-chloroethyl)-N-cyclobutyl-4-fluoro-2-methylbenzamide
CID 102872612
N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide
CID 115745878

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide?
The IUPAC name of N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide (CID 115745650) is N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide.
What is the SMILES notation for N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide?
The canonical SMILES for N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide is Cc1cc(F)ccc1C(=O)N(C)C1CC1.
What is the InChIKey of N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide?
The InChIKey is GZFGDXBZXOXLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c1-8-7-9(13)3-6-11(8)12(15)14(2)10-4-5-10/h3,6-7,10H,4-5H2,1-2H3.
What are the key properties of N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide?
N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide has a molecular weight of 207.25 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide is sourced from PubChem (CID 115745650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).