N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester

C9H14N4O2 — CID 129717466

IUPACethyl 2-[(4-amino-6-methylpyrimidin-2-yl)amino]acetate
SMILESCCOC(=O)CNC1=NC(=CC(=N1)N)C
InChIInChI=1S/C9H14N4O2/c1-3-15-8(14)5-11-9-12-6(2)4-7(10)13-9/h4H,3,5H2,1-2H3,(H3,10,11,12,13)
InChIKeyVQLYCXMQXSAHPL-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.90
Rot. Bonds5

About N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester

N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester (PubChem CID 129717466) has the molecular formula C9H14N4O2 and a molecular weight of 210.23 g/mol. Its IUPAC name is ethyl 2-[(4-amino-6-methylpyrimidin-2-yl)amino]acetate.

Molecular Properties

Compound NameN-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester
PubChem CID129717466
Molecular FormulaC9H14N4O2
Molecular Weight210.23 g/mol
Exact Mass210.11
IUPAC Nameethyl 2-[(4-amino-6-methylpyrimidin-2-yl)amino]acetate
SMILESCCOC(=O)CNC1=NC(=CC(=N1)N)C
InChIInChI=1S/C9H14N4O2/c1-3-15-8(14)5-11-9-12-6(2)4-7(10)13-9/h4H,3,5H2,1-2H3,(H3,10,11,12,13)
InChIKeyVQLYCXMQXSAHPL-UHFFFAOYSA-N
XLogP0.90
TPSA90.10 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms15
Complexity212

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N,6-dimethyl-2-morpholin-4-ylpyrimidin-4-amine
CID 697248
[Cyano-(4,6-dimethyl-pyrimidin-2-yl)-amino]-acetic acid ethyl ester
CID 1827932
N-butyl-6-methyl-2-(4-morpholinyl)-4-pyrimidinamine
CID 1880359
2-Amino-4-morpholino-6-methylpyrimidine
CID 3642905
[Cyano-(4,6-dimethyl-pyrimidin-2-yl)-amino]-acetic acid methyl ester
CID 694914
2-(6-Methyl-2-morpholin-4-yl-pyrimidin-4-ylamino)-ethanol
CID 1918227
6-Methyl-2-(morpholin-4-yl)pyrimidin-4-amine
CID 13537844
2-[(6-Methyl-2-propyl-4-pyrimidinyl)amino]ethanol
CID 6459535
2-chloro-6-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
CID 55080944
Glycine, N-(4,6-dimethyl-2-pyrimidinyl)-
CID 312674
6-methyl-N~4~-(3-morpholin-4-ylpropyl)pyrimidine-2,4-diamine
CID 72921477
2,6-dimethyl-N-(3-morpholin-4-ylcyclobutyl)pyrimidin-4-amine
CID 126823280

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester?
The IUPAC name of N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester (CID 129717466) is ethyl 2-[(4-amino-6-methylpyrimidin-2-yl)amino]acetate.
What is the SMILES notation for N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester?
The canonical SMILES for N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester is CCOC(=O)CNC1=NC(=CC(=N1)N)C.
What is the InChIKey of N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester?
The InChIKey is VQLYCXMQXSAHPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-3-15-8(14)5-11-9-12-6(2)4-7(10)13-9/h4H,3,5H2,1-2H3,(H3,10,11,12,13).
What are the key properties of N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester?
N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester has a molecular weight of 210.23 g/mol, XLogP of 0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-6-methyl-2-pyrimidyl)-glycine ethyl ester is sourced from PubChem (CID 129717466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).