4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine

C8H8N4O — CID 102923030

IUPAC4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine
SMILESCc1c(N)noc1-c1cncnc1
InChIInChI=1S/C8H8N4O/c1-5-7(13-12-8(5)9)6-2-10-4-11-3-6/h2-4H,1H3,(H2,9,12)
InChIKeyROLQQEIQLCXYHE-UHFFFAOYSA-N
MW176.18 g/mol
LogP1.02
Rot. Bonds1

About 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine

4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine (PubChem CID 102923030) has the molecular formula C8H8N4O and a molecular weight of 176.18 g/mol. Its IUPAC name is 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine
PubChem CID102923030
Molecular FormulaC8H8N4O
Molecular Weight176.18 g/mol
Exact Mass176.07
IUPAC Name4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine
SMILESCc1c(N)noc1-c1cncnc1
InChIInChI=1S/C8H8N4O/c1-5-7(13-12-8(5)9)6-2-10-4-11-3-6/h2-4H,1H3,(H2,9,12)
InChIKeyROLQQEIQLCXYHE-UHFFFAOYSA-N
XLogP1.02
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.18
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-phenyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine
CID 102923019
3-(3-amino-4-methyl-1,2-oxazol-5-yl)phenol
CID 105444092
5-(3-chloro-4-methylthiophen-2-yl)-4-methyl-1,2-oxazol-3-amine
CID 103406991
4-methyl-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine
CID 66200401
5-(4-chloro-1-methylpyrazol-5-yl)-4-methyl-1,2-oxazol-3-amine
CID 164655342
5-(2-chlorophenyl)-4-methyl-1,2-oxazol-3-amine
CID 66198805
5-(2-fluoro-3-methylphenyl)-4-methyl-1,2-oxazol-3-amine
CID 81479051
2-ethyl-5-methyl-6-pyrimidin-5-ylpyrimidin-4-amine
CID 80975669
4-bromo-5-(3,5-dimethylphenyl)-1,2-oxazol-3-amine
CID 79555953
5-(5-chloro-2-methylphenyl)-4-methyl-1,2-oxazol-3-amine
CID 82890379
5-(2,4-difluorophenyl)-4-methyl-1,2-oxazol-3-amine
CID 66199002
4-ethyl-3-pyrimidin-5-yl-1,2-oxazol-5-amine
CID 102922020

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine?
The IUPAC name of 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine (CID 102923030) is 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine.
What is the SMILES notation for 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine?
The canonical SMILES for 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine is Cc1c(N)noc1-c1cncnc1.
What is the InChIKey of 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine?
The InChIKey is ROLQQEIQLCXYHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O/c1-5-7(13-12-8(5)9)6-2-10-4-11-3-6/h2-4H,1H3,(H2,9,12).
What are the key properties of 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine?
4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine has a molecular weight of 176.18 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-pyrimidin-5-yl-1,2-oxazol-3-amine is sourced from PubChem (CID 102923030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).