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

C11H19N5O2 — CID 80806380

IUPACN-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide
SMILESCNc1cc(N(C)CC(=O)NCCOC)ncn1
InChIInChI=1S/C11H19N5O2/c1-12-9-6-10(15-8-14-9)16(2)7-11(17)13-4-5-18-3/h6,8H,4-5,7H2,1-3H3,(H,13,17)(H,12,14,15)
InChIKeyGDXUNRAAQZJAMB-UHFFFAOYSA-N
MW253.31 g/mol
LogP-0.28
Rot. Bonds7

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

N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide (PubChem CID 80806380) has the molecular formula C11H19N5O2 and a molecular weight of 253.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide
PubChem CID80806380
Molecular FormulaC11H19N5O2
Molecular Weight253.31 g/mol
Exact Mass253.15
IUPAC NameN-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide
SMILESCNc1cc(N(C)CC(=O)NCCOC)ncn1
InChIInChI=1S/C11H19N5O2/c1-12-9-6-10(15-8-14-9)16(2)7-11(17)13-4-5-18-3/h6,8H,4-5,7H2,1-3H3,(H,13,17)(H,12,14,15)
InChIKeyGDXUNRAAQZJAMB-UHFFFAOYSA-N
XLogP-0.28
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide
CID 80779288
2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 80652005
2-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]-N-(2-methoxyethyl)acetamide
CID 80940171
2-[(5-formyl-2-pyridinyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 80638047
2-[(5-bromo-6-chloropyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 114071706
2-[(6-chloropyrimidin-4-yl)-methylamino]-N-propylacetamide
CID 60725995
6-[[2-(2-methoxyethylamino)-2-oxoethyl]-methylamino]-5-methylpyridine-3-carboxylic acid
CID 80632539
2-[[6-chloro-2-(trifluoromethyl)pyrimidin-4-yl]-methylamino]-N-(2-methoxyethyl)acetamide
CID 106767470
5-chloro-N-[2-(2-methoxyethylamino)-2-oxoethyl]-2-(methylamino)pyridine-4-carboxamide
CID 114924409
2-[ethyl-[6-(methylamino)pyrimidin-4-yl]amino]-N-methylacetamide
CID 80809279
N-(2-methoxyethyl)-2-[methyl-[5-(propylaminomethyl)-2-pyridinyl]amino]acetamide
CID 80632056
2-[(4,6-dichloro-1,3,5-triazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 55023792

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide (CID 80806380) is N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide is CNc1cc(N(C)CC(=O)NCCOC)ncn1.
What is the InChIKey of N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide?
The InChIKey is GDXUNRAAQZJAMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2/c1-12-9-6-10(15-8-14-9)16(2)7-11(17)13-4-5-18-3/h6,8H,4-5,7H2,1-3H3,(H,13,17)(H,12,14,15).
What are the key properties of N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide?
N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide has a molecular weight of 253.31 g/mol, XLogP of -0.28, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 80806380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).