N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide

C19H21FN2O2S — CID 1433196

IUPACN-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)N(CC(=O)NC2CCCC2)c2cccc(F)c2)s1
InChIInChI=1S/C19H21FN2O2S/c1-13-9-10-17(25-13)19(24)22(16-8-4-5-14(20)11-16)12-18(23)21-15-6-2-3-7-15/h4-5,8-11,15H,2-3,6-7,12H2,1H3,(H,21,23)
InChIKeyHSAQIQCFJNNUCL-UHFFFAOYSA-N
MW360.45 g/mol
LogP3.90
Rot. Bonds5

About N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide

N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide (PubChem CID 1433196) has the molecular formula C19H21FN2O2S and a molecular weight of 360.45 g/mol. Its IUPAC name is N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide
PubChem CID1433196
Molecular FormulaC19H21FN2O2S
Molecular Weight360.45 g/mol
Exact Mass360.13
IUPAC NameN-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)N(CC(=O)NC2CCCC2)c2cccc(F)c2)s1
InChIInChI=1S/C19H21FN2O2S/c1-13-9-10-17(25-13)19(24)22(16-8-4-5-14(20)11-16)12-18(23)21-15-6-2-3-7-15/h4-5,8-11,15H,2-3,6-7,12H2,1H3,(H,21,23)
InChIKeyHSAQIQCFJNNUCL-UHFFFAOYSA-N
XLogP3.90
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.45
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(N-[2-(cyclohexylamino)-2-oxoethyl]-3-fluoroanilino)-2-oxoethyl]thiophene-2-carboxamide
CID 3211290
N-cyclohexyl-4-(5-methylthiophen-2-yl)-4-oxobutanamide
CID 18108619
N-[2-(cyclohexylamino)-2-oxoethyl]-5-methyl-N-prop-2-enylthiophene-2-carboxamide
CID 1442233
4,5-dichloro-N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-methylphenyl)-1,2-thiazole-3-carboxamide
CID 1463083
N-cyclohexyl-2-(N,3-diacetylanilino)acetamide
CID 113175380
N-[2-(cyclohexylamino)-1-(5-methylthiophen-2-yl)-2-oxoethyl]-2,2,2-trifluoro-N-(3-fluorophenyl)acetamide
CID 3216424
N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide
CID 109005664
2-(N-acetylanilino)-N-cyclopentylacetamide
CID 113167073
N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-3-indazol-1-ylpropanamide
CID 1433423
N-[2-(N-[2-(cyclohexylamino)-2-oxoethyl]-3-methylanilino)-2-oxoethyl]thiophene-2-carboxamide
CID 3691071
N-(3-chlorophenyl)-N-[2-(cyclopentylamino)-2-oxoethyl]thiadiazole-4-carboxamide
CID 1467648
2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide
CID 113167455

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide?
The IUPAC name of N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide (CID 1433196) is N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide is Cc1ccc(C(=O)N(CC(=O)NC2CCCC2)c2cccc(F)c2)s1.
What is the InChIKey of N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide?
The InChIKey is HSAQIQCFJNNUCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O2S/c1-13-9-10-17(25-13)19(24)22(16-8-4-5-14(20)11-16)12-18(23)21-15-6-2-3-7-15/h4-5,8-11,15H,2-3,6-7,12H2,1H3,(H,21,23).
What are the key properties of N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide?
N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide has a molecular weight of 360.45 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-fluorophenyl)-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 1433196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).