2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide

C20H15N3OS — CID 7615397

IUPAC2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide
SMILESO=C(Nc1ncnc2sccc12)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H15N3OS/c24-19(23-18-16-11-12-25-20(16)22-13-21-18)17(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,17H,(H,21,22,23,24)
InChIKeySWUIRRUIXYJEJB-UHFFFAOYSA-N
MW345.43 g/mol
LogP4.46
Rot. Bonds4

About 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide

2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide (PubChem CID 7615397) has the molecular formula C20H15N3OS and a molecular weight of 345.43 g/mol. Its IUPAC name is 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide
PubChem CID7615397
Molecular FormulaC20H15N3OS
Molecular Weight345.43 g/mol
Exact Mass345.09
IUPAC Name2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide
SMILESO=C(Nc1ncnc2sccc12)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H15N3OS/c24-19(23-18-16-11-12-25-20(16)22-13-21-18)17(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,17H,(H,21,22,23,24)
InChIKeySWUIRRUIXYJEJB-UHFFFAOYSA-N
XLogP4.46
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.43
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N,2-diphenyl-2-(thieno[2,3-d]pyrimidin-4-ylamino)acetamide
CID 94546891
N-[(R)-cyclopropyl(phenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 41332400
3-(benzenesulfonyl)-N-thieno[2,3-d]pyrimidin-4-ylpropanamide
CID 7615443
2-(1,3-dioxoisoindol-2-yl)-N-thieno[2,3-d]pyrimidin-4-ylacetamide
CID 7615382
(2R)-3-methyl-2-(thieno[2,3-d]pyrimidin-4-ylamino)butanoic acid
CID 93263493
2-nitro-N-thieno[2,3-d]pyrimidin-4-ylbenzamide
CID 7615411
N-(3-phenylbutyl)thieno[2,3-d]pyrimidin-4-amine
CID 62402452
2-(thieno[2,3-d]pyrimidin-4-ylamino)pentanoic acid
CID 43631382
N-[(S)-furan-2-yl(phenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 9450827
2-methyl-2-(thieno[2,3-d]pyrimidin-4-ylamino)propanoic acid
CID 61265918
(2R)-N-(4-fluorophenyl)-2-phenyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide
CID 7889230
N-[(1R)-1-phenyl-2-pyrrolidin-1-ylethyl]thieno[2,3-d]pyrimidin-4-amine
CID 36725383

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide?
The IUPAC name of 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide (CID 7615397) is 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide.
What is the SMILES notation for 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide?
The canonical SMILES for 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide is O=C(Nc1ncnc2sccc12)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide?
The InChIKey is SWUIRRUIXYJEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3OS/c24-19(23-18-16-11-12-25-20(16)22-13-21-18)17(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,17H,(H,21,22,23,24).
What are the key properties of 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide?
2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide has a molecular weight of 345.43 g/mol, XLogP of 4.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide is sourced from PubChem (CID 7615397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).