N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide

C24H26N4O — CID 1448074

IUPACN-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide
SMILESCC(=O)NC1(c2ccccc2)CCN(c2cc(C)nc(-c3ccccc3)n2)CC1
InChIInChI=1S/C24H26N4O/c1-18-17-22(26-23(25-18)20-9-5-3-6-10-20)28-15-13-24(14-16-28,27-19(2)29)21-11-7-4-8-12-21/h3-12,17H,13-16H2,1-2H3,(H,27,29)
InChIKeyWFJXDLYYEDRZLL-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.08
Rot. Bonds4

About N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide

N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide (PubChem CID 1448074) has the molecular formula C24H26N4O and a molecular weight of 386.50 g/mol. Its IUPAC name is N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide
PubChem CID1448074
Molecular FormulaC24H26N4O
Molecular Weight386.50 g/mol
Exact Mass386.21
IUPAC NameN-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide
SMILESCC(=O)NC1(c2ccccc2)CCN(c2cc(C)nc(-c3ccccc3)n2)CC1
InChIInChI=1S/C24H26N4O/c1-18-17-22(26-23(25-18)20-9-5-3-6-10-20)28-15-13-24(14-16-28,27-19(2)29)21-11-7-4-8-12-21/h3-12,17H,13-16H2,1-2H3,(H,27,29)
InChIKeyWFJXDLYYEDRZLL-UHFFFAOYSA-N
XLogP4.08
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide?
The IUPAC name of N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide (CID 1448074) is N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide.
What is the SMILES notation for N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide?
The canonical SMILES for N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide is CC(=O)NC1(c2ccccc2)CCN(c2cc(C)nc(-c3ccccc3)n2)CC1.
What is the InChIKey of N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide?
The InChIKey is WFJXDLYYEDRZLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O/c1-18-17-22(26-23(25-18)20-9-5-3-6-10-20)28-15-13-24(14-16-28,27-19(2)29)21-11-7-4-8-12-21/h3-12,17H,13-16H2,1-2H3,(H,27,29).
What are the key properties of N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide?
N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide has a molecular weight of 386.50 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-methyl-2-phenylpyrimidin-4-yl)-4-phenylpiperidin-4-yl]acetamide is sourced from PubChem (CID 1448074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).