6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine

C11H13ClN4O2 — CID 106375507

IUPAC6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine
SMILESCOCc1nc(Cl)cc(NCc2ncc(C)o2)n1
InChIInChI=1S/C11H13ClN4O2/c1-7-4-14-11(18-7)5-13-9-3-8(12)15-10(16-9)6-17-2/h3-4H,5-6H2,1-2H3,(H,13,15,16)
InChIKeyTZGBZOQCLGGSQT-UHFFFAOYSA-N
MW268.70 g/mol
LogP2.18
Rot. Bonds5

About 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine

6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine (PubChem CID 106375507) has the molecular formula C11H13ClN4O2 and a molecular weight of 268.70 g/mol. Its IUPAC name is 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine
PubChem CID106375507
Molecular FormulaC11H13ClN4O2
Molecular Weight268.70 g/mol
Exact Mass268.07
IUPAC Name6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine
SMILESCOCc1nc(Cl)cc(NCc2ncc(C)o2)n1
InChIInChI=1S/C11H13ClN4O2/c1-7-4-14-11(18-7)5-13-9-3-8(12)15-10(16-9)6-17-2/h3-4H,5-6H2,1-2H3,(H,13,15,16)
InChIKeyTZGBZOQCLGGSQT-UHFFFAOYSA-N
XLogP2.18
TPSA73.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.70
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine (CID 106375507) is 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine is COCc1nc(Cl)cc(NCc2ncc(C)o2)n1.
What is the InChIKey of 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is TZGBZOQCLGGSQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN4O2/c1-7-4-14-11(18-7)5-13-9-3-8(12)15-10(16-9)6-17-2/h3-4H,5-6H2,1-2H3,(H,13,15,16).
What are the key properties of 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine?
6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 268.70 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(methoxymethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 106375507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).