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

C13H19N5O — CID 106378623

IUPAC2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine
SMILESCCc1nc(NC)c(C)c(NCc2ncc(C)o2)n1
InChIInChI=1S/C13H19N5O/c1-5-10-17-12(14-4)9(3)13(18-10)16-7-11-15-6-8(2)19-11/h6H,5,7H2,1-4H3,(H2,14,16,17,18)
InChIKeyMGYPQVKNKMBMHU-UHFFFAOYSA-N
MW261.33 g/mol
LogP2.30
Rot. Bonds5

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

2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine (PubChem CID 106378623) has the molecular formula C13H19N5O and a molecular weight of 261.33 g/mol. Its IUPAC name is 2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine
PubChem CID106378623
Molecular FormulaC13H19N5O
Molecular Weight261.33 g/mol
Exact Mass261.16
IUPAC Name2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine
SMILESCCc1nc(NC)c(C)c(NCc2ncc(C)o2)n1
InChIInChI=1S/C13H19N5O/c1-5-10-17-12(14-4)9(3)13(18-10)16-7-11-15-6-8(2)19-11/h6H,5,7H2,1-4H3,(H2,14,16,17,18)
InChIKeyMGYPQVKNKMBMHU-UHFFFAOYSA-N
XLogP2.30
TPSA75.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

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Related Compounds

6-N,2-diethyl-5-methyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine
CID 106378700
6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propylpyrimidine-4,6-diamine
CID 106378740
6-chloro-2,5-dimethyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine
CID 106375469
6-N-methyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-5-propan-2-ylpyrimidine-4,6-diamine
CID 106378719
2-ethyl-6-N,5-dimethyl-4-N-propylpyrimidine-4,6-diamine
CID 80982045
2-ethyl-4-N-[(4-fluorophenyl)methyl]-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80982081
2-ethyl-6-N,5-dimethyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-4,6-diamine
CID 80981203
2-ethyl-6-N,5-dimethyl-4-N-[(4-methylthiophen-3-yl)methyl]pyrimidine-4,6-diamine
CID 80992974
4-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-6-N,2-diethyl-5-methylpyrimidine-4,6-diamine
CID 106378873
5-chloro-2-N-ethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-2,4-diamine
CID 106378760
2-ethyl-4-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-N,5-dimethylpyrimidine-4,6-diamine
CID 106304573
3,5-difluoro-6-hydrazinyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyridin-2-amine
CID 106379001

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine?
The IUPAC name of 2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine (CID 106378623) is 2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine.
What is the SMILES notation for 2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine?
The canonical SMILES for 2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine is CCc1nc(NC)c(C)c(NCc2ncc(C)o2)n1.
What is the InChIKey of 2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine?
The InChIKey is MGYPQVKNKMBMHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O/c1-5-10-17-12(14-4)9(3)13(18-10)16-7-11-15-6-8(2)19-11/h6H,5,7H2,1-4H3,(H2,14,16,17,18).
What are the key properties of 2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine?
2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine has a molecular weight of 261.33 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-N,5-dimethyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-4,6-diamine is sourced from PubChem (CID 106378623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).