N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide

C22H24N4O4S — CID 55786094

IUPACN-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
SMILESCc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccc(N2CC(C)OC(C)C2)nc1
InChIInChI=1S/C22H24N4O4S/c1-13-9-19(25-21(27)17-5-4-8-29-17)31-20(13)22(28)24-16-6-7-18(23-10-16)26-11-14(2)30-15(3)12-26/h4-10,14-15H,11-12H2,1-3H3,(H,24,28)(H,25,27)
InChIKeyNLAJKFIXLUIWCB-UHFFFAOYSA-N
MW440.53 g/mol
LogP4.16
Rot. Bonds5

About N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide

N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide (PubChem CID 55786094) has the molecular formula C22H24N4O4S and a molecular weight of 440.53 g/mol. Its IUPAC name is N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
PubChem CID55786094
Molecular FormulaC22H24N4O4S
Molecular Weight440.53 g/mol
Exact Mass440.15
IUPAC NameN-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
SMILESCc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccc(N2CC(C)OC(C)C2)nc1
InChIInChI=1S/C22H24N4O4S/c1-13-9-19(25-21(27)17-5-4-8-29-17)31-20(13)22(28)24-16-6-7-18(23-10-16)26-11-14(2)30-15(3)12-26/h4-10,14-15H,11-12H2,1-3H3,(H,24,28)(H,25,27)
InChIKeyNLAJKFIXLUIWCB-UHFFFAOYSA-N
XLogP4.16
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.53
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide with MolForge

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Related Compounds

N-[5-[(4-fluorophenyl)carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 17491245
cis-(1R,3S)-3-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 120677533
N-[5-[[4-(cyanomethyl)phenyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 35708139
4-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 119230122
N-[5-[[1-[2-(diethylamino)ethyl]pyrazol-4-yl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 47926915
N-[5-[(2,3-dimethylphenyl)carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 29284081
1-[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]pyrrolidine-3-carboxylic acid
CID 119354056
N-[5-[(4-hydroxycyclohexyl)carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 110882782
N-[2-methyl-5-[(6-pyrrolidin-1-yl-3-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide
CID 30266978
N-[6-(4-pyridin-2-ylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide
CID 113014476
N-[5-[(3-chloro-4-cyclopentyloxyphenyl)carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 60574915
2-(2,6-dimethylmorpholin-4-yl)-5-(furan-2-carbonylamino)benzoic acid
CID 2804715

Frequently Asked Questions

What is the IUPAC name of N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide?
The IUPAC name of N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide (CID 55786094) is N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide is Cc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccc(N2CC(C)OC(C)C2)nc1.
What is the InChIKey of N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide?
The InChIKey is NLAJKFIXLUIWCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O4S/c1-13-9-19(25-21(27)17-5-4-8-29-17)31-20(13)22(28)24-16-6-7-18(23-10-16)26-11-14(2)30-15(3)12-26/h4-10,14-15H,11-12H2,1-3H3,(H,24,28)(H,25,27).
What are the key properties of N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide?
N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide has a molecular weight of 440.53 g/mol, XLogP of 4.16, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide is sourced from PubChem (CID 55786094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).