4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide

C16H24FNO — CID 112702512

IUPAC4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide
SMILESCc1cc(F)ccc1C(=O)N(CC(C)C)CC(C)C
InChIInChI=1S/C16H24FNO/c1-11(2)9-18(10-12(3)4)16(19)15-7-6-14(17)8-13(15)5/h6-8,11-12H,9-10H2,1-5H3
InChIKeyMFXGVUDBIXLHFZ-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.89
Rot. Bonds5

About 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide

4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide (PubChem CID 112702512) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide.

Molecular Properties

Compound Name4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide
PubChem CID112702512
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide
SMILESCc1cc(F)ccc1C(=O)N(CC(C)C)CC(C)C
InChIInChI=1S/C16H24FNO/c1-11(2)9-18(10-12(3)4)16(19)15-7-6-14(17)8-13(15)5/h6-8,11-12H,9-10H2,1-5H3
InChIKeyMFXGVUDBIXLHFZ-UHFFFAOYSA-N
XLogP3.89
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-N,2-dimethyl-N-(3-methylbutyl)benzamide
CID 112702416
2-[(2,4-difluorobenzoyl)-(2-methylpropyl)amino]acetic acid
CID 62034804
4-fluoro-N,N-bis(2-methylpropyl)benzamide
CID 17386163
4-fluoro-N,N,2-trimethylbenzamide
CID 115745346
5-amino-2,4-dimethyl-N,N-bis(2-methylpropyl)benzamide
CID 102705085
N-benzyl-N-ethyl-4-fluoro-2-methylbenzamide
CID 115745298
N-(2-amino-2-oxoethyl)-4-hydroxy-2-methyl-N-(2-methylpropyl)benzamide
CID 103865180
2-[(7-fluoro-2-methylquinoline-3-carbonyl)-(2-methylpropyl)amino]acetic acid
CID 119192837
5-amino-2-methyl-N,N-bis(2-methylpropyl)benzamide
CID 61291739
1-(4-fluoro-2-methylphenyl)-2-propan-2-ylsulfanylethanone
CID 65134273
4-fluoro-2-methyl-N-(2-methylpropoxy)benzamide
CID 112703509
2-amino-N-(2-amino-2-oxoethyl)-5-fluoro-N-(2-methylpropyl)benzamide
CID 60962629

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide?
The IUPAC name of 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide (CID 112702512) is 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide.
What is the SMILES notation for 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide?
The canonical SMILES for 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide is Cc1cc(F)ccc1C(=O)N(CC(C)C)CC(C)C.
What is the InChIKey of 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide?
The InChIKey is MFXGVUDBIXLHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-11(2)9-18(10-12(3)4)16(19)15-7-6-14(17)8-13(15)5/h6-8,11-12H,9-10H2,1-5H3.
What are the key properties of 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide?
4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide has a molecular weight of 265.37 g/mol, XLogP of 3.89, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-methyl-N,N-bis(2-methylpropyl)benzamide is sourced from PubChem (CID 112702512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).