N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide

C14H18FNO — CID 115745878

IUPACN-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide
SMILESCc1cc(F)ccc1C(=O)N(C)CC1CCC1
InChIInChI=1S/C14H18FNO/c1-10-8-12(15)6-7-13(10)14(17)16(2)9-11-4-3-5-11/h6-8,11H,3-5,9H2,1-2H3
InChIKeyFUQVCSJLITWSJI-UHFFFAOYSA-N
MW235.30 g/mol
LogP3.01
Rot. Bonds3

About N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide

N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide (PubChem CID 115745878) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide
PubChem CID115745878
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC NameN-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide
SMILESCc1cc(F)ccc1C(=O)N(C)CC1CCC1
InChIInChI=1S/C14H18FNO/c1-10-8-12(15)6-7-13(10)14(17)16(2)9-11-4-3-5-11/h6-8,11H,3-5,9H2,1-2H3
InChIKeyFUQVCSJLITWSJI-UHFFFAOYSA-N
XLogP3.01
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-amino-N-(cyclobutylmethyl)-4-fluoro-N-methylbenzamide
CID 63110420
N-(cyclobutylmethyl)-5-fluoro-2-hydroxy-N-methylbenzamide
CID 79882440
N-(cyclopropylmethyl)-2,4-difluoro-N-methylbenzamide
CID 94158144
N-cyclobutyl-4-fluoro-N,2-dimethylbenzamide
CID 115745905
N-cycloheptyl-4-fluoro-N,2-dimethylbenzamide
CID 113268593
2-[cyclobutylmethyl(methyl)carbamoyl]-4-fluorobenzenesulfonyl chloride
CID 62861010
5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627610
N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide
CID 115745650
5-amino-N-(cyclobutylmethyl)-2-fluoro-N,3-dimethylbenzamide
CID 103296416
2,4-difluoro-N-methyl-N-(piperidin-4-ylmethyl)benzamide
CID 79715450
N-(2-chloroethyl)-N-cyclobutyl-4-fluoro-2-methylbenzamide
CID 102872612
1-(cyclohexylmethyl)-3-(4-fluoro-2-methylphenyl)-1-methylurea
CID 47032646

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide?
The IUPAC name of N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide (CID 115745878) is N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide.
What is the SMILES notation for N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide?
The canonical SMILES for N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide is Cc1cc(F)ccc1C(=O)N(C)CC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide?
The InChIKey is FUQVCSJLITWSJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-10-8-12(15)6-7-13(10)14(17)16(2)9-11-4-3-5-11/h6-8,11H,3-5,9H2,1-2H3.
What are the key properties of N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide?
N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide has a molecular weight of 235.30 g/mol, XLogP of 3.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide is sourced from PubChem (CID 115745878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).