N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide

C11H19N5O — CID 80779921

IUPACN,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide
SMILESCNc1nc(C)cc(N(C)CC(=O)N(C)C)n1
InChIInChI=1S/C11H19N5O/c1-8-6-9(14-11(12-2)13-8)16(5)7-10(17)15(3)4/h6H,7H2,1-5H3,(H,12,13,14)
InChIKeyTWLARZLDDKUZJV-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.35
Rot. Bonds4

About N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide

N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide (PubChem CID 80779921) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide
PubChem CID80779921
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC NameN,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide
SMILESCNc1nc(C)cc(N(C)CC(=O)N(C)C)n1
InChIInChI=1S/C11H19N5O/c1-8-6-9(14-11(12-2)13-8)16(5)7-10(17)15(3)4/h6H,7H2,1-5H3,(H,12,13,14)
InChIKeyTWLARZLDDKUZJV-UHFFFAOYSA-N
XLogP0.35
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide?
The IUPAC name of N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide (CID 80779921) is N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide?
The canonical SMILES for N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide is CNc1nc(C)cc(N(C)CC(=O)N(C)C)n1.
What is the InChIKey of N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide?
The InChIKey is TWLARZLDDKUZJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-8-6-9(14-11(12-2)13-8)16(5)7-10(17)15(3)4/h6H,7H2,1-5H3,(H,12,13,14).
What are the key properties of N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide?
N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide has a molecular weight of 237.31 g/mol, XLogP of 0.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 80779921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).