N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide

C16H16N2O3S — CID 653867

IUPACN-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1cccs1
InChIInChI=1S/C16H16N2O3S/c19-15(14-2-1-11-22-14)17-13-5-3-12(4-6-13)16(20)18-7-9-21-10-8-18/h1-6,11H,7-10H2,(H,17,19)
InChIKeyOACWYJNHXKFZBE-UHFFFAOYSA-N
MW316.38 g/mol
LogP2.47
Rot. Bonds3

About N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide

N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide (PubChem CID 653867) has the molecular formula C16H16N2O3S and a molecular weight of 316.38 g/mol. Its IUPAC name is N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide
PubChem CID653867
Molecular FormulaC16H16N2O3S
Molecular Weight316.38 g/mol
Exact Mass316.09
IUPAC NameN-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1cccs1
InChIInChI=1S/C16H16N2O3S/c19-15(14-2-1-11-22-14)17-13-5-3-12(4-6-13)16(20)18-7-9-21-10-8-18/h1-6,11H,7-10H2,(H,17,19)
InChIKeyOACWYJNHXKFZBE-UHFFFAOYSA-N
XLogP2.47
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 761867
N-[4-[4-[2-(methylamino)-2-oxoethyl]piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide
CID 78801385
N-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)phenyl]thiophene-2-carboxamide
CID 42470301
N-[4-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide
CID 9181732
N-[4-[(thiophene-2-carbonylamino)carbamoyl]phenyl]thiophene-2-carboxamide
CID 1117998
N-[4-(5-bromo-4-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 100652972
N-[4-[[(2R)-3-methyl-2-morpholin-4-ylbutyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 25473941
N-[4-(morpholine-4-carbonyl)phenyl]-1-benzothiophene-3-carboxamide
CID 2971227
N-[4-[(3-ethyl-2-morpholin-4-ylpentyl)carbamoyl]phenyl]thiophene-2-carboxamide
CID 43046396
2-morpholin-4-yl-5-(thiophene-2-carbonylamino)benzoic acid
CID 783853
N-(4-acetylphenyl)thiophene-2-carboxamide
CID 573780
N-[3-[[4-(morpholin-4-ylmethyl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 78804636

Frequently Asked Questions

What is the IUPAC name of N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide (CID 653867) is N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide is O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1cccs1.
What is the InChIKey of N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide?
The InChIKey is OACWYJNHXKFZBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3S/c19-15(14-2-1-11-22-14)17-13-5-3-12(4-6-13)16(20)18-7-9-21-10-8-18/h1-6,11H,7-10H2,(H,17,19).
What are the key properties of N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide?
N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide has a molecular weight of 316.38 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 653867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).