2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide

C25H21N3O — CID 91816035

IUPAC2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(NCc1cccnc1-c1ccncc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H21N3O/c29-25(23(19-8-3-1-4-9-19)20-10-5-2-6-11-20)28-18-22-12-7-15-27-24(22)21-13-16-26-17-14-21/h1-17,23H,18H2,(H,28,29)
InChIKeyZXLVUOSRFQZIOQ-UHFFFAOYSA-N
MW379.46 g/mol
LogP4.59
Rot. Bonds6

About 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide

2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide (PubChem CID 91816035) has the molecular formula C25H21N3O and a molecular weight of 379.46 g/mol. Its IUPAC name is 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide
PubChem CID91816035
Molecular FormulaC25H21N3O
Molecular Weight379.46 g/mol
Exact Mass379.17
IUPAC Name2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(NCc1cccnc1-c1ccncc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H21N3O/c29-25(23(19-8-3-1-4-9-19)20-10-5-2-6-11-20)28-18-22-12-7-15-27-24(22)21-13-16-26-17-14-21/h1-17,23H,18H2,(H,28,29)
InChIKeyZXLVUOSRFQZIOQ-UHFFFAOYSA-N
XLogP4.59
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2-pyridin-4-yl-3-pyridinyl)methyl]-3-[2-(trifluoromethyl)phenyl]urea
CID 91816064
2-oxo-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]chromene-3-carboxamide
CID 91816022
(1S)-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]cyclohex-3-ene-1-carboxamide
CID 100742816
N-[(2-pyridin-4-yl-3-pyridinyl)methyl]-3-[4-(trifluoromethyl)phenyl]propanamide
CID 91816031
N-[(2-pyridin-4-yl-3-pyridinyl)methyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 91816053
(2R)-2-[(2,2-diphenylacetyl)amino]-3-phenyl-N-(pyridin-4-ylmethyl)propanamide
CID 2666614
2-hydroxy-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 82130126
2,2-diphenyl-N-[[3-(1,3-thiazol-2-yl)phenyl]methyl]acetamide
CID 54774183
2,2-diphenyl-N-[(1-pyridin-4-yltriazol-4-yl)methyl]acetamide
CID 121195878
N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]prop-2-enamide
CID 53148242
1-benzhydryl-3-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]urea
CID 122275518
N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2,2-diphenylacetamide
CID 37426840

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide (CID 91816035) is 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide is O=C(NCc1cccnc1-c1ccncc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide?
The InChIKey is ZXLVUOSRFQZIOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N3O/c29-25(23(19-8-3-1-4-9-19)20-10-5-2-6-11-20)28-18-22-12-7-15-27-24(22)21-13-16-26-17-14-21/h1-17,23H,18H2,(H,28,29).
What are the key properties of 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide?
2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide has a molecular weight of 379.46 g/mol, XLogP of 4.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-[(2-pyridin-4-yl-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 91816035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).