N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide

C14H15FN2OS — CID 110468020

IUPACN-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide
SMILESCC(C)(CNC(=O)c1nccs1)c1ccccc1F
InChIInChI=1S/C14H15FN2OS/c1-14(2,10-5-3-4-6-11(10)15)9-17-12(18)13-16-7-8-19-13/h3-8H,9H2,1-2H3,(H,17,18)
InChIKeyLTSMJZXWIUFEFD-UHFFFAOYSA-N
MW278.35 g/mol
LogP2.99
Rot. Bonds4

About N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide

N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide (PubChem CID 110468020) has the molecular formula C14H15FN2OS and a molecular weight of 278.35 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide
PubChem CID110468020
Molecular FormulaC14H15FN2OS
Molecular Weight278.35 g/mol
Exact Mass278.09
IUPAC NameN-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide
SMILESCC(C)(CNC(=O)c1nccs1)c1ccccc1F
InChIInChI=1S/C14H15FN2OS/c1-14(2,10-5-3-4-6-11(10)15)9-17-12(18)13-16-7-8-19-13/h3-8H,9H2,1-2H3,(H,17,18)
InChIKeyLTSMJZXWIUFEFD-UHFFFAOYSA-N
XLogP2.99
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methyl-2-phenylpropyl)-1,3-thiazole-2-carboxamide
CID 110467972
3-ethyl-N-[2-(2-fluorophenyl)-2-methylpropyl]thiophene-2-carboxamide
CID 52834645
5-[[2-(2-fluorophenyl)-2-methylpropyl]carbamoyl]pyrazine-2-carboxylic acid
CID 120685423
5-[[2-(2-fluorophenyl)-2-methylpropyl]carbamoyl]thiophene-2-carboxylic acid
CID 119183626
2-amino-N-[2-(2-fluorophenyl)-2-methylpropyl]-2-phenylpropanamide
CID 120591195
N-[2-(2-fluorophenyl)-2-methylpropyl]-3,4-dimethoxybenzamide
CID 110441404
N-[2-(2-fluorophenyl)-2-methylpropyl]-3-methylbutanamide
CID 110442195
N-[2-[[2-(2-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]thiophene-3-carboxamide
CID 51104213
N-(2,2-diphenylethyl)-1,3-thiazole-2-carboxamide
CID 91094529
N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide
CID 115159146
3-fluoro-N-(2-methyl-2-phenylpropyl)pyridine-2-carboxamide
CID 110474878
2-[[2-(2-fluorophenyl)-2-methylpropyl]amino]acetic acid
CID 115218193

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide (CID 110468020) is N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide is CC(C)(CNC(=O)c1nccs1)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide?
The InChIKey is LTSMJZXWIUFEFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2OS/c1-14(2,10-5-3-4-6-11(10)15)9-17-12(18)13-16-7-8-19-13/h3-8H,9H2,1-2H3,(H,17,18).
What are the key properties of N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide?
N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-2-methylpropyl]-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 110468020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).