2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide

C11H19N5O — CID 80981186

IUPAC2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide
SMILESCNc1nc(C(C)C)nc(NCC(N)=O)c1C
InChIInChI=1S/C11H19N5O/c1-6(2)9-15-10(13-4)7(3)11(16-9)14-5-8(12)17/h6H,5H2,1-4H3,(H2,12,17)(H2,13,14,15,16)
InChIKeyYCNTUGHUJOVEMO-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.85
Rot. Bonds5

About 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide

2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide (PubChem CID 80981186) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound Name2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide
PubChem CID80981186
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide
SMILESCNc1nc(C(C)C)nc(NCC(N)=O)c1C
InChIInChI=1S/C11H19N5O/c1-6(2)9-15-10(13-4)7(3)11(16-9)14-5-8(12)17/h6H,5H2,1-4H3,(H2,12,17)(H2,13,14,15,16)
InChIKeyYCNTUGHUJOVEMO-UHFFFAOYSA-N
XLogP0.85
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[2-tert-butyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide
CID 80981514
4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]butan-2-ol
CID 80992534
N-[2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]ethyl]acetamide
CID 80993574
2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol
CID 115366534
2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide
CID 103104381
4-N-(2-methoxypropyl)-6-N,5-dimethyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 102701807
4-N-(2-methoxy-2-methylpropyl)-6-N,5-dimethyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 104767223
4-[(6-amino-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]butanamide
CID 80993947
N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide
CID 103113889
6-ethyl-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 63560963
6-N,5-dimethyl-2-propan-2-yl-4-N-(pyridazin-3-ylmethyl)pyrimidine-4,6-diamine
CID 106898131
6-N,5-dimethyl-4-N-(2-phenylethyl)-2-propan-2-ylpyrimidine-4,6-diamine
CID 80980846

Frequently Asked Questions

What is the IUPAC name of 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide?
The IUPAC name of 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide (CID 80981186) is 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide?
The canonical SMILES for 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide is CNc1nc(C(C)C)nc(NCC(N)=O)c1C.
What is the InChIKey of 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide?
The InChIKey is YCNTUGHUJOVEMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-6(2)9-15-10(13-4)7(3)11(16-9)14-5-8(12)17/h6H,5H2,1-4H3,(H2,12,17)(H2,13,14,15,16).
What are the key properties of 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide?
2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide has a molecular weight of 237.31 g/mol, XLogP of 0.85, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 80981186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).