2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide

C26H25N5O2S — CID 25124467

IUPAC2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide
SMILESNC(=O)c1cc(-c2ccc(-c3ccncc3)cc2)sc1Nc1cccc(CN2CCOCC2)n1
InChIInChI=1S/C26H25N5O2S/c27-25(32)22-16-23(20-6-4-18(5-7-20)19-8-10-28-11-9-19)34-26(22)30-24-3-1-2-21(29-24)17-31-12-14-33-15-13-31/h1-11,16H,12-15,17H2,(H2,27,32)(H,29,30)
InChIKeyRATBCHTZPSYKDP-UHFFFAOYSA-N
MW471.59 g/mol
LogP4.55
Rot. Bonds7

About 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide

2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide (PubChem CID 25124467) has the molecular formula C26H25N5O2S and a molecular weight of 471.59 g/mol. Its IUPAC name is 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide
PubChem CID25124467
Molecular FormulaC26H25N5O2S
Molecular Weight471.59 g/mol
Exact Mass471.17
IUPAC Name2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide
SMILESNC(=O)c1cc(-c2ccc(-c3ccncc3)cc2)sc1Nc1cccc(CN2CCOCC2)n1
InChIInChI=1S/C26H25N5O2S/c27-25(32)22-16-23(20-6-4-18(5-7-20)19-8-10-28-11-9-19)34-26(22)30-24-3-1-2-21(29-24)17-31-12-14-33-15-13-31/h1-11,16H,12-15,17H2,(H2,27,32)(H,29,30)
InChIKeyRATBCHTZPSYKDP-UHFFFAOYSA-N
XLogP4.55
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.59
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide with MolForge

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Related Compounds

2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-pyridin-1-ium-4-ylthiophene-3-carboxamide
CID 163556947
2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyrazol-1-ylphenyl)thiophene-3-carboxamide
CID 25124468
5-ethynyl-2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]thiophene-3-carboxamide
CID 59526270
5-[2-fluoro-4-(2-hydroxypropyl)phenyl]-2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]thiophene-3-carboxamide
CID 68741098
2-[[6-[(4-acetylpiperazin-1-yl)methyl]-2-pyridinyl]amino]-5-[4-(1-hydroxypropan-2-yl)phenyl]thiophene-3-carboxamide
CID 25124145
5-[4-(1,1-dioxo-1,4-thiazinan-4-yl)phenyl]-2-[[2-(morpholin-4-ylmethyl)pyrimidin-4-yl]amino]thiophene-3-carboxamide
CID 59525683
2-[[6-[(2,6-dimethylmorpholin-4-yl)methyl]-2-pyridinyl]amino]-5-[2-fluoro-4-(2-hydroxypropan-2-yl)phenyl]thiophene-3-carboxamide
CID 59525658
5-phenyl-2-(pyridin-2-ylamino)thiophene-3-carboxamide
CID 25127137
2-[[6-[(3,3-difluoroazetidin-1-yl)methyl]-2-pyridinyl]amino]-5-[2-fluoro-4-(2-hydroxypropan-2-yl)phenyl]thiophene-3-carboxamide
CID 59526101
2-(carbamoylamino)-5-[4-(2-morpholin-4-ylethoxy)phenyl]thiophene-3-carboxamide
CID 10221992
N-methyl-6-(morpholin-4-ylmethyl)pyridin-2-amine
CID 79242984
2-[[5-(2-hydroxypropan-2-yl)-6-methyl-2-pyridinyl]amino]-5-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide
CID 59525820

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide?
The IUPAC name of 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide (CID 25124467) is 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide.
What is the SMILES notation for 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide?
The canonical SMILES for 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide is NC(=O)c1cc(-c2ccc(-c3ccncc3)cc2)sc1Nc1cccc(CN2CCOCC2)n1.
What is the InChIKey of 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide?
The InChIKey is RATBCHTZPSYKDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N5O2S/c27-25(32)22-16-23(20-6-4-18(5-7-20)19-8-10-28-11-9-19)34-26(22)30-24-3-1-2-21(29-24)17-31-12-14-33-15-13-31/h1-11,16H,12-15,17H2,(H2,27,32)(H,29,30).
What are the key properties of 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide?
2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide has a molecular weight of 471.59 g/mol, XLogP of 4.55, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(morpholin-4-ylmethyl)-2-pyridinyl]amino]-5-(4-pyridin-4-ylphenyl)thiophene-3-carboxamide is sourced from PubChem (CID 25124467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).