4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide

C15H16FNOS — CID 112702369

IUPAC4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
SMILESCc1cc(F)ccc1C(=O)NC(C)Cc1cccs1
InChIInChI=1S/C15H16FNOS/c1-10-8-12(16)5-6-14(10)15(18)17-11(2)9-13-4-3-7-19-13/h3-8,11H,9H2,1-2H3,(H,17,18)
InChIKeyGVRTXIOTXPWSRT-UHFFFAOYSA-N
MW277.36 g/mol
LogP3.56
Rot. Bonds4

About 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide

4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide (PubChem CID 112702369) has the molecular formula C15H16FNOS and a molecular weight of 277.36 g/mol. Its IUPAC name is 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide.

Molecular Properties

Compound Name4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
PubChem CID112702369
Molecular FormulaC15H16FNOS
Molecular Weight277.36 g/mol
Exact Mass277.09
IUPAC Name4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
SMILESCc1cc(F)ccc1C(=O)NC(C)Cc1cccs1
InChIInChI=1S/C15H16FNOS/c1-10-8-12(16)5-6-14(10)15(18)17-11(2)9-13-4-3-7-19-13/h3-8,11H,9H2,1-2H3,(H,17,18)
InChIKeyGVRTXIOTXPWSRT-UHFFFAOYSA-N
XLogP3.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-3-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 63212844
3-bromo-4-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 79467456
2-fluoro-N-(1-thiophen-2-ylpropan-2-yl)pyridine-3-carboxamide
CID 107358824
3,4-dihydroxy-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 103956007
4-(4-fluorophenyl)-4-oxo-N-(1-thiophen-2-ylpropan-2-yl)butanamide
CID 86930480
2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 63295814
3,4-dichloro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 18711929
methane;N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 159530206
4-fluoro-N-[4-(furan-2-yl)butan-2-yl]-2-methylbenzamide
CID 115745188
2-(ethylamino)-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 63107914
4-(aminomethyl)-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 43705091
2-amino-3-chloro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 115540690

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide?
The IUPAC name of 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide (CID 112702369) is 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide.
What is the SMILES notation for 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide?
The canonical SMILES for 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide is Cc1cc(F)ccc1C(=O)NC(C)Cc1cccs1.
What is the InChIKey of 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide?
The InChIKey is GVRTXIOTXPWSRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNOS/c1-10-8-12(16)5-6-14(10)15(18)17-11(2)9-13-4-3-7-19-13/h3-8,11H,9H2,1-2H3,(H,17,18).
What are the key properties of 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide?
4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide has a molecular weight of 277.36 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide is sourced from PubChem (CID 112702369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).