5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine

C14H17N5O — CID 106389547

IUPAC5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine
SMILESCc1cnc(C(C)n2c(C)c(C)c3c(N)ncnc32)o1
InChIInChI=1S/C14H17N5O/c1-7-5-16-14(20-7)10(4)19-9(3)8(2)11-12(15)17-6-18-13(11)19/h5-6,10H,1-4H3,(H2,15,17,18)
InChIKeyRDFXOPZFCGWFIO-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.54
Rot. Bonds2

About 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine

5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine (PubChem CID 106389547) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine
PubChem CID106389547
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine
SMILESCc1cnc(C(C)n2c(C)c(C)c3c(N)ncnc32)o1
InChIInChI=1S/C14H17N5O/c1-7-5-16-14(20-7)10(4)19-9(3)8(2)11-12(15)17-6-18-13(11)19/h5-6,10H,1-4H3,(H2,15,17,18)
InChIKeyRDFXOPZFCGWFIO-UHFFFAOYSA-N
XLogP2.54
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine with MolForge

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Related Compounds

5,6-dimethyl-7-[1-(5-methylthiophen-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine
CID 61477536
5,6-dimethyl-7-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine
CID 62118135
7-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
CID 43337023
7-(2,3-dimethylbutyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
CID 64597836
5,6-dimethyl-7-(5-methylhexyl)pyrrolo[2,3-d]pyrimidin-4-amine
CID 115326743
7-(2-methoxypropyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
CID 102700019
7-(4-methoxyphenyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
CID 4962416
7-(2-ethylhexyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
CID 107817677
7-(2-bromo-4-methylphenyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
CID 43337037
4-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-5-sulfanylidene-1,2,4-triazolidin-3-one
CID 106389871
7-(2,3-dimethylphenyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
CID 43336950
2-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzene-1,2-diamine
CID 106387648

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine (CID 106389547) is 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine is Cc1cnc(C(C)n2c(C)c(C)c3c(N)ncnc32)o1.
What is the InChIKey of 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine?
The InChIKey is RDFXOPZFCGWFIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-7-5-16-14(20-7)10(4)19-9(3)8(2)11-12(15)17-6-18-13(11)19/h5-6,10H,1-4H3,(H2,15,17,18).
What are the key properties of 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine?
5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine has a molecular weight of 271.32 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-7-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolo[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 106389547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).