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

C14H17N5O — CID 94496981

IUPAC(2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide
SMILESCNC(=O)[C@H](Nc1cc(C)nc(N)n1)c1ccccc1
InChIInChI=1S/C14H17N5O/c1-9-8-11(19-14(15)17-9)18-12(13(20)16-2)10-6-4-3-5-7-10/h3-8,12H,1-2H3,(H,16,20)(H3,15,17,18,19)/t12-/m1/s1
InChIKeyPMPREMJULXGMRZ-GFCCVEGCSA-N
MW271.32 g/mol
LogP1.27
Rot. Bonds4

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

(2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide (PubChem CID 94496981) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is (2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide
PubChem CID94496981
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name(2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide
SMILESCNC(=O)[C@H](Nc1cc(C)nc(N)n1)c1ccccc1
InChIInChI=1S/C14H17N5O/c1-9-8-11(19-14(15)17-9)18-12(13(20)16-2)10-6-4-3-5-7-10/h3-8,12H,1-2H3,(H,16,20)(H3,15,17,18,19)/t12-/m1/s1
InChIKeyPMPREMJULXGMRZ-GFCCVEGCSA-N
XLogP1.27
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-N-methyl-2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-2-phenylacetamide
CID 154859336
N-methyl-2-(methylamino)-2-phenylacetamide
CID 3738076
4-N-[1-(3-chlorophenyl)ethyl]-6-methylpyrimidine-2,4-diamine
CID 113221029
4-N-(1-phenylethyl)pyrimidine-2,4,6-triamine
CID 80769538
methyl 2-[(2-methylpyrimidin-4-yl)amino]-2-phenylacetate
CID 62785286
N,N'-dimethyl-2,3-diphenylbutanediamide
CID 15634660
4,6-dimethylpyrimidin-2-amine;2-methylbenzoic acid
CID 139144557
N-methyl-2-phenyl-2-(propan-2-ylcarbamoylamino)acetamide
CID 47075853
6-methyl-4-N-[1-(5-methylfuran-2-yl)ethyl]pyrimidine-2,4-diamine
CID 112724390
(2S)-2-amino-N-methyl-2-phenylacetamide;hydrochloride
CID 68552126
N-(4,6-dimethyl-2-pyridinyl)-2,2-diphenylacetamide
CID 844918
(2S)-2-(3,5-dimethylanilino)-2-phenylacetamide
CID 25348784

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide?
The IUPAC name of (2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide (CID 94496981) is (2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide.
What is the SMILES notation for (2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide?
The canonical SMILES for (2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide is CNC(=O)[C@H](Nc1cc(C)nc(N)n1)c1ccccc1.
What is the InChIKey of (2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide?
The InChIKey is PMPREMJULXGMRZ-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H17N5O/c1-9-8-11(19-14(15)17-9)18-12(13(20)16-2)10-6-4-3-5-7-10/h3-8,12H,1-2H3,(H,16,20)(H3,15,17,18,19)/t12-/m1/s1.
What are the key properties of (2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide?
(2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide has a molecular weight of 271.32 g/mol, XLogP of 1.27, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2-amino-6-methylpyrimidin-4-yl)amino]-N-methyl-2-phenylacetamide is sourced from PubChem (CID 94496981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).