(2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide

C19H19N5O — CID 154859336

IUPAC(2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide
SMILESCNC(=O)[C@H](Nc1cc(-c2ccccn2)nc(C)n1)c1ccccc1
InChIInChI=1S/C19H19N5O/c1-13-22-16(15-10-6-7-11-21-15)12-17(23-13)24-18(19(25)20-2)14-8-4-3-5-9-14/h3-12,18H,1-2H3,(H,20,25)(H,22,23,24)/t18-/m1/s1
InChIKeyRMYMFTBUEOWPBQ-GOSISDBHSA-N
MW333.40 g/mol
LogP2.75
Rot. Bonds5

About (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide

(2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide (PubChem CID 154859336) has the molecular formula C19H19N5O and a molecular weight of 333.40 g/mol. Its IUPAC name is (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide
PubChem CID154859336
Molecular FormulaC19H19N5O
Molecular Weight333.40 g/mol
Exact Mass333.16
IUPAC Name(2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide
SMILESCNC(=O)[C@H](Nc1cc(-c2ccccn2)nc(C)n1)c1ccccc1
InChIInChI=1S/C19H19N5O/c1-13-22-16(15-10-6-7-11-21-15)12-17(23-13)24-18(19(25)20-2)14-8-4-3-5-9-14/h3-12,18H,1-2H3,(H,20,25)(H,22,23,24)/t18-/m1/s1
InChIKeyRMYMFTBUEOWPBQ-GOSISDBHSA-N
XLogP2.75
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.40
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide?
The IUPAC name of (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide (CID 154859336) is (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide.
What is the SMILES notation for (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide?
The canonical SMILES for (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide is CNC(=O)[C@H](Nc1cc(-c2ccccn2)nc(C)n1)c1ccccc1.
What is the InChIKey of (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide?
The InChIKey is RMYMFTBUEOWPBQ-GOSISDBHSA-N. The full InChI is InChI=1S/C19H19N5O/c1-13-22-16(15-10-6-7-11-21-15)12-17(23-13)24-18(19(25)20-2)14-8-4-3-5-9-14/h3-12,18H,1-2H3,(H,20,25)(H,22,23,24)/t18-/m1/s1.
What are the key properties of (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide?
(2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide has a molecular weight of 333.40 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide is sourced from PubChem (CID 154859336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).