2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide

C10H17N5O — CID 80780164

IUPAC2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide
SMILESCCc1c(N)ncnc1N(C)CC(=O)NC
InChIInChI=1S/C10H17N5O/c1-4-7-9(11)13-6-14-10(7)15(3)5-8(16)12-2/h6H,4-5H2,1-3H3,(H,12,16)(H2,11,13,14)
InChIKeyQQWORTWUJBSXRX-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.20
Rot. Bonds4

About 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide

2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide (PubChem CID 80780164) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide
PubChem CID80780164
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide
SMILESCCc1c(N)ncnc1N(C)CC(=O)NC
InChIInChI=1S/C10H17N5O/c1-4-7-9(11)13-6-14-10(7)15(3)5-8(16)12-2/h6H,4-5H2,1-3H3,(H,12,16)(H2,11,13,14)
InChIKeyQQWORTWUJBSXRX-UHFFFAOYSA-N
XLogP-0.20
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-methylamino]-N-methylacetamide
CID 80894065
2-[(6-amino-5-ethylpyrimidin-4-yl)-ethylamino]-N-ethylacetamide
CID 80805333
N-ethyl-2-[[5-ethyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80804475
5-ethyl-4-N-methyl-4-N-(3,3,3-trifluoropropyl)pyrimidine-4,6-diamine
CID 80847664
2-[(6-amino-5-nitropyrimidin-4-yl)-ethylamino]-N-methylacetamide
CID 80808990
2-[[5-ethyl-6-(methylamino)pyrimidin-4-yl]-propylamino]-N-methylacetamide
CID 80806342
2-[(6-amino-5-ethylpyrimidin-4-yl)-butylamino]acetamide
CID 80821348
4-N-butan-2-yl-5-ethyl-4-N-methylpyrimidine-4,6-diamine
CID 80776680
3-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-methylamino]-N,2-dimethylpropanamide
CID 106918799
4-[methyl-[2-(methylamino)-2-oxoethyl]amino]quinazoline-7-carboxylic acid
CID 63263648
2-[(3-amino-6-methyl-2-pyridinyl)-methylamino]-N-methylacetamide
CID 81132412
N,N-diethyl-2-[[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80779733

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide?
The IUPAC name of 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide (CID 80780164) is 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide.
What is the SMILES notation for 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide?
The canonical SMILES for 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide is CCc1c(N)ncnc1N(C)CC(=O)NC.
What is the InChIKey of 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide?
The InChIKey is QQWORTWUJBSXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-4-7-9(11)13-6-14-10(7)15(3)5-8(16)12-2/h6H,4-5H2,1-3H3,(H,12,16)(H2,11,13,14).
What are the key properties of 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide?
2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide has a molecular weight of 223.28 g/mol, XLogP of -0.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-5-ethylpyrimidin-4-yl)-methylamino]-N-methylacetamide is sourced from PubChem (CID 80780164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).