2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide

C16H19FN2OS — CID 63295814

IUPAC2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
SMILESCCNc1c(F)cccc1C(=O)NC(C)Cc1cccs1
InChIInChI=1S/C16H19FN2OS/c1-3-18-15-13(7-4-8-14(15)17)16(20)19-11(2)10-12-6-5-9-21-12/h4-9,11,18H,3,10H2,1-2H3,(H,19,20)
InChIKeyRBFSLVHXDWCVJZ-UHFFFAOYSA-N
MW306.41 g/mol
LogP3.68
Rot. Bonds6

About 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide

2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide (PubChem CID 63295814) has the molecular formula C16H19FN2OS and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide.

Molecular Properties

Compound Name2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
PubChem CID63295814
Molecular FormulaC16H19FN2OS
Molecular Weight306.41 g/mol
Exact Mass306.12
IUPAC Name2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
SMILESCCNc1c(F)cccc1C(=O)NC(C)Cc1cccs1
InChIInChI=1S/C16H19FN2OS/c1-3-18-15-13(7-4-8-14(15)17)16(20)19-11(2)10-12-6-5-9-21-12/h4-9,11,18H,3,10H2,1-2H3,(H,19,20)
InChIKeyRBFSLVHXDWCVJZ-UHFFFAOYSA-N
XLogP3.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(ethylamino)-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 63107914
2-(ethylamino)-3-fluoro-N-heptan-2-ylbenzamide
CID 62662293
2-fluoro-N-(1-thiophen-2-ylpropan-2-yl)pyridine-3-carboxamide
CID 107358824
2-amino-3-chloro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 115540690
3-amino-2-chloro-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 112575891
4-fluoro-2-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 112702369
N-ethyl-2-(ethylamino)-3-fluorobenzamide
CID 62648907
5-(ethylamino)-N-(1-thiophen-2-ylpropan-2-yl)pyridine-2-carboxamide
CID 104641309
N-(dicyclopropylmethyl)-2-(ethylamino)-3-fluorobenzamide
CID 62662474
4-fluoro-3-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 63212844
methane;N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 159530206
2,3-dimethyl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]-1H-indole-7-carboxamide
CID 42461714

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide?
The IUPAC name of 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide (CID 63295814) is 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide.
What is the SMILES notation for 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide?
The canonical SMILES for 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide is CCNc1c(F)cccc1C(=O)NC(C)Cc1cccs1.
What is the InChIKey of 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide?
The InChIKey is RBFSLVHXDWCVJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2OS/c1-3-18-15-13(7-4-8-14(15)17)16(20)19-11(2)10-12-6-5-9-21-12/h4-9,11,18H,3,10H2,1-2H3,(H,19,20).
What are the key properties of 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide?
2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide has a molecular weight of 306.41 g/mol, XLogP of 3.68, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-3-fluoro-N-(1-thiophen-2-ylpropan-2-yl)benzamide is sourced from PubChem (CID 63295814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).