4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine

C14H21N5O — CID 80941304

IUPAC4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine
SMILESCCc1nc(NC)cc(NC(C)c2c(C)noc2C)n1
InChIInChI=1S/C14H21N5O/c1-6-11-17-12(15-5)7-13(18-11)16-8(2)14-9(3)19-20-10(14)4/h7-8H,6H2,1-5H3,(H2,15,16,17,18)
InChIKeyDFZLLAYYIIDEEN-UHFFFAOYSA-N
MW275.36 g/mol
LogP2.86
Rot. Bonds5

About 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine

4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine (PubChem CID 80941304) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine
PubChem CID80941304
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine
SMILESCCc1nc(NC)cc(NC(C)c2c(C)noc2C)n1
InChIInChI=1S/C14H21N5O/c1-6-11-17-12(15-5)7-13(18-11)16-8(2)14-9(3)19-20-10(14)4/h7-8H,6H2,1-5H3,(H2,15,16,17,18)
InChIKeyDFZLLAYYIIDEEN-UHFFFAOYSA-N
XLogP2.86
TPSA75.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine with MolForge

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Related Compounds

2-ethyl-6-N-methyl-4-N-(1-thiophen-2-ylethyl)pyrimidine-4,6-diamine
CID 80933955
6-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-N-propylpyridine-2,6-diamine
CID 80848647
2-ethyl-N-methyl-6-propan-2-ylpyrimidin-4-amine
CID 62192702
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-6-ethyl-2-methylpyrimidin-4-amine
CID 133462111
6-chloro-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyridin-2-amine
CID 79237569
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrimidin-2-amine
CID 78961774
2-ethyl-N,6-dimethylpyrimidin-4-amine
CID 62192654
8-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80836295
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]naphthalen-2-amine
CID 79242430
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-methyl-1,2,4-oxadiazol-5-amine
CID 106659817
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-4-methyl-1,3-thiazol-2-amine
CID 79242353
1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80933620

Frequently Asked Questions

What is the IUPAC name of 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine (CID 80941304) is 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine is CCc1nc(NC)cc(NC(C)c2c(C)noc2C)n1.
What is the InChIKey of 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine?
The InChIKey is DFZLLAYYIIDEEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-6-11-17-12(15-5)7-13(18-11)16-8(2)14-9(3)19-20-10(14)4/h7-8H,6H2,1-5H3,(H2,15,16,17,18).
What are the key properties of 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine?
4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine has a molecular weight of 275.36 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine is sourced from PubChem (CID 80941304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).