2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide

C14H25N5O2 — CID 80987749

IUPAC2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide
SMILESCCCc1nc(N)c(C)c(N(C)CC(=O)NCCOC)n1
InChIInChI=1S/C14H25N5O2/c1-5-6-11-17-13(15)10(2)14(18-11)19(3)9-12(20)16-7-8-21-4/h5-9H2,1-4H3,(H,16,20)(H2,15,17,18)
InChIKeyYAOAIKXRUWLISV-UHFFFAOYSA-N
MW295.39 g/mol
LogP0.52
Rot. Bonds8

About 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide

2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide (PubChem CID 80987749) has the molecular formula C14H25N5O2 and a molecular weight of 295.39 g/mol. Its IUPAC name is 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide
PubChem CID80987749
Molecular FormulaC14H25N5O2
Molecular Weight295.39 g/mol
Exact Mass295.20
IUPAC Name2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide
SMILESCCCc1nc(N)c(C)c(N(C)CC(=O)NCCOC)n1
InChIInChI=1S/C14H25N5O2/c1-5-6-11-17-13(15)10(2)14(18-11)19(3)9-12(20)16-7-8-21-4/h5-9H2,1-4H3,(H,16,20)(H2,15,17,18)
InChIKeyYAOAIKXRUWLISV-UHFFFAOYSA-N
XLogP0.52
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 50.52
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-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-propylacetamide
CID 80986192
2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-cyclopropylacetamide
CID 80983230
2-[(6-amino-2,5-dimethylpyrimidin-4-yl)-methylamino]-N-propylacetamide
CID 80808785
N-ethyl-2-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80987499
2-[(3-amino-6-methyl-2-pyridinyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 81132098
2-[(5-amino-3-bromo-4-methyl-2-pyridinyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 104506622
2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-methylamino]-N-propan-2-ylacetamide
CID 80982333
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 66029961
2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-methylacetamide
CID 80970815
2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide
CID 80987636
2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 80652005
2-[(5-amino-6-oxo-1H-pyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 137009322

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide (CID 80987749) is 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide is CCCc1nc(N)c(C)c(N(C)CC(=O)NCCOC)n1.
What is the InChIKey of 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide?
The InChIKey is YAOAIKXRUWLISV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O2/c1-5-6-11-17-13(15)10(2)14(18-11)19(3)9-12(20)16-7-8-21-4/h5-9H2,1-4H3,(H,16,20)(H2,15,17,18).
What are the key properties of 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide?
2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide has a molecular weight of 295.39 g/mol, XLogP of 0.52, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 80987749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).