N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine

C10H11FN4O — CID 106375375

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine
SMILESCCc1cnc(CNc2cc(F)ncn2)o1
InChIInChI=1S/C10H11FN4O/c1-2-7-4-13-10(16-7)5-12-9-3-8(11)14-6-15-9/h3-4,6H,2,5H2,1H3,(H,12,14,15)
InChIKeySBKYZDQLPCNFSP-UHFFFAOYSA-N
MW222.22 g/mol
LogP1.78
Rot. Bonds4

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine (PubChem CID 106375375) has the molecular formula C10H11FN4O and a molecular weight of 222.22 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine
PubChem CID106375375
Molecular FormulaC10H11FN4O
Molecular Weight222.22 g/mol
Exact Mass222.09
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine
SMILESCCc1cnc(CNc2cc(F)ncn2)o1
InChIInChI=1S/C10H11FN4O/c1-2-7-4-13-10(16-7)5-12-9-3-8(11)14-6-15-9/h3-4,6H,2,5H2,1H3,(H,12,14,15)
InChIKeySBKYZDQLPCNFSP-UHFFFAOYSA-N
XLogP1.78
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.22
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-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 N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine (CID 106375375) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine is CCc1cnc(CNc2cc(F)ncn2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine?
The InChIKey is SBKYZDQLPCNFSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN4O/c1-2-7-4-13-10(16-7)5-12-9-3-8(11)14-6-15-9/h3-4,6H,2,5H2,1H3,(H,12,14,15).
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine has a molecular weight of 222.22 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoropyrimidin-4-amine is sourced from PubChem (CID 106375375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).