2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide

C24H26N4O — CID 91966645

IUPAC2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide
SMILESO=C(NCc1nccc(N2CCCCC2)n1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H26N4O/c29-24(23(19-10-4-1-5-11-19)20-12-6-2-7-13-20)26-18-21-25-15-14-22(27-21)28-16-8-3-9-17-28/h1-2,4-7,10-15,23H,3,8-9,16-18H2,(H,26,29)
InChIKeyKDYCDGZMCYGCNE-UHFFFAOYSA-N
MW386.50 g/mol
LogP3.92
Rot. Bonds6

About 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide

2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide (PubChem CID 91966645) has the molecular formula C24H26N4O and a molecular weight of 386.50 g/mol. Its IUPAC name is 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide
PubChem CID91966645
Molecular FormulaC24H26N4O
Molecular Weight386.50 g/mol
Exact Mass386.21
IUPAC Name2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide
SMILESO=C(NCc1nccc(N2CCCCC2)n1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H26N4O/c29-24(23(19-10-4-1-5-11-19)20-12-6-2-7-13-20)26-18-21-25-15-14-22(27-21)28-16-8-3-9-17-28/h1-2,4-7,10-15,23H,3,8-9,16-18H2,(H,26,29)
InChIKeyKDYCDGZMCYGCNE-UHFFFAOYSA-N
XLogP3.92
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-pyrrolidin-1-ylpyrimidin-2-yl)methyl]benzamide
CID 72717998
N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]-2-pyrazol-1-ylpropanamide
CID 122318604
N-[(4-pyrrolidin-1-ylpyrimidin-2-yl)methyl]cyclohexanecarboxamide
CID 72717997
N-[(4-pyrrolidin-1-ylpyrimidin-2-yl)methyl]propanamide
CID 121137119
N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]-2-phenylbutanamide
CID 72718115
2,2-dimethyl-N-[(4-pyrrolidin-1-ylpyrimidin-2-yl)methyl]propanamide
CID 72717995
2-cyclopentyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide
CID 122318482
2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide
CID 72718086
3-chloro-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]benzamide
CID 91966623
1-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]-3-[2-(trifluoromethoxy)phenyl]urea
CID 122318452
N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]benzenesulfonamide
CID 72718077
N-[(4-pyrrolidin-1-ylpyrimidin-2-yl)methyl]-1,2-oxazole-5-carboxamide
CID 122317397

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide?
The IUPAC name of 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide (CID 91966645) is 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide.
What is the SMILES notation for 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide?
The canonical SMILES for 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide is O=C(NCc1nccc(N2CCCCC2)n1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide?
The InChIKey is KDYCDGZMCYGCNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O/c29-24(23(19-10-4-1-5-11-19)20-12-6-2-7-13-20)26-18-21-25-15-14-22(27-21)28-16-8-3-9-17-28/h1-2,4-7,10-15,23H,3,8-9,16-18H2,(H,26,29).
What are the key properties of 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide?
2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide has a molecular weight of 386.50 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]acetamide is sourced from PubChem (CID 91966645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).