2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide

C11H19N5O — CID 80993390

IUPAC2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide
SMILESCCc1nc(NC)c(C)c(N(C)CC(N)=O)n1
InChIInChI=1S/C11H19N5O/c1-5-9-14-10(13-3)7(2)11(15-9)16(4)6-8(12)17/h5-6H2,1-4H3,(H2,12,17)(H,13,14,15)
InChIKeyQMULTPDCCDRUEI-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.31
Rot. Bonds5

About 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide

2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide (PubChem CID 80993390) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide.

Molecular Properties

Compound Name2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide
PubChem CID80993390
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide
SMILESCCc1nc(NC)c(C)c(N(C)CC(N)=O)n1
InChIInChI=1S/C11H19N5O/c1-5-9-14-10(13-3)7(2)11(15-9)16(4)6-8(12)17/h5-6H2,1-4H3,(H2,12,17)(H,13,14,15)
InChIKeyQMULTPDCCDRUEI-UHFFFAOYSA-N
XLogP0.31
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80779123
2-[butyl-[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide
CID 80982412
2-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80993475
N-ethyl-2-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80987499
2-[ethyl-[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]-N-methylacetamide
CID 80987036
2-ethyl-4-N,6-N,5-trimethyl-4-N-(2-methylbutyl)pyrimidine-4,6-diamine
CID 80993377
2-[[2-tert-butyl-6-(ethylamino)-5-methylpyrimidin-4-yl]-methylamino]acetamide
CID 80993837
N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide
CID 106918503
2-ethyl-4-N,6-N,5-trimethyl-4-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidine-4,6-diamine
CID 80982568
4-N-[2-(cyclopropylmethoxy)ethyl]-2-ethyl-4-N,6-N,5-trimethylpyrimidine-4,6-diamine
CID 80992976
2-ethyl-4-N-(furan-3-ylmethyl)-4-N,6-N,5-trimethylpyrimidine-4,6-diamine
CID 80987787
6-(2,2-dimethylhydrazinyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 83026946

Frequently Asked Questions

What is the IUPAC name of 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide?
The IUPAC name of 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide (CID 80993390) is 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide.
What is the SMILES notation for 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide?
The canonical SMILES for 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide is CCc1nc(NC)c(C)c(N(C)CC(N)=O)n1.
What is the InChIKey of 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide?
The InChIKey is QMULTPDCCDRUEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-5-9-14-10(13-3)7(2)11(15-9)16(4)6-8(12)17/h5-6H2,1-4H3,(H2,12,17)(H,13,14,15).
What are the key properties of 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide?
2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide has a molecular weight of 237.31 g/mol, XLogP of 0.31, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide is sourced from PubChem (CID 80993390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).