N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide

C18H14N2O3S — CID 869374

IUPACN-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1cccc(NC(=O)c2cccs2)c1
InChIInChI=1S/C18H14N2O3S/c21-15-7-2-6-14(11-15)19-17(22)12-4-1-5-13(10-12)20-18(23)16-8-3-9-24-16/h1-11,21H,(H,19,22)(H,20,23)
InChIKeyRFBZYRMLQURAPP-UHFFFAOYSA-N
MW338.39 g/mol
LogP3.96
Rot. Bonds4

About N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide

N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide (PubChem CID 869374) has the molecular formula C18H14N2O3S and a molecular weight of 338.39 g/mol. Its IUPAC name is N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
PubChem CID869374
Molecular FormulaC18H14N2O3S
Molecular Weight338.39 g/mol
Exact Mass338.07
IUPAC NameN-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1cccc(NC(=O)c2cccs2)c1
InChIInChI=1S/C18H14N2O3S/c21-15-7-2-6-14(11-15)19-17(22)12-4-1-5-13(10-12)20-18(23)16-8-3-9-24-16/h1-11,21H,(H,19,22)(H,20,23)
InChIKeyRFBZYRMLQURAPP-UHFFFAOYSA-N
XLogP3.96
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 53.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide (CID 869374) is N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide is O=C(Nc1cccc(O)c1)c1cccc(NC(=O)c2cccs2)c1.
What is the InChIKey of N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide?
The InChIKey is RFBZYRMLQURAPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O3S/c21-15-7-2-6-14(11-15)19-17(22)12-4-1-5-13(10-12)20-18(23)16-8-3-9-24-16/h1-11,21H,(H,19,22)(H,20,23).
What are the key properties of N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide?
N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide has a molecular weight of 338.39 g/mol, XLogP of 3.96, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 869374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).