N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide

C15H27N5O — CID 103113889

IUPACN-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide
SMILESCCN(C)C(=O)C(C)Nc1nc(C(C)C)nc(NC)c1C
InChIInChI=1S/C15H27N5O/c1-8-20(7)15(21)11(5)17-14-10(4)13(16-6)18-12(19-14)9(2)3/h9,11H,8H2,1-7H3,(H2,16,17,18,19)
InChIKeyPSNOFEGTFXUVAN-UHFFFAOYSA-N
MW293.42 g/mol
LogP2.23
Rot. Bonds6

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

N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide (PubChem CID 103113889) has the molecular formula C15H27N5O and a molecular weight of 293.42 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide
PubChem CID103113889
Molecular FormulaC15H27N5O
Molecular Weight293.42 g/mol
Exact Mass293.22
IUPAC NameN-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide
SMILESCCN(C)C(=O)C(C)Nc1nc(C(C)C)nc(NC)c1C
InChIInChI=1S/C15H27N5O/c1-8-20(7)15(21)11(5)17-14-10(4)13(16-6)18-12(19-14)9(2)3/h9,11H,8H2,1-7H3,(H2,16,17,18,19)
InChIKeyPSNOFEGTFXUVAN-UHFFFAOYSA-N
XLogP2.23
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.42
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide?
The IUPAC name of N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide (CID 103113889) is N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide.
What is the SMILES notation for N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide?
The canonical SMILES for N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide is CCN(C)C(=O)C(C)Nc1nc(C(C)C)nc(NC)c1C.
What is the InChIKey of N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide?
The InChIKey is PSNOFEGTFXUVAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-8-20(7)15(21)11(5)17-14-10(4)13(16-6)18-12(19-14)9(2)3/h9,11H,8H2,1-7H3,(H2,16,17,18,19).
What are the key properties of N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide?
N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide has a molecular weight of 293.42 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propanamide is sourced from PubChem (CID 103113889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).