6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine

C14H23N3O — CID 65328095

IUPAC6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine
SMILESCCNc1cc(C(C)(C)C)nc(C2CCCO2)n1
InChIInChI=1S/C14H23N3O/c1-5-15-12-9-11(14(2,3)4)16-13(17-12)10-7-6-8-18-10/h9-10H,5-8H2,1-4H3,(H,15,16,17)
InChIKeyAYOIJALGCNJBKS-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.06
Rot. Bonds3

About 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine

6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine (PubChem CID 65328095) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine
PubChem CID65328095
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine
SMILESCCNc1cc(C(C)(C)C)nc(C2CCCO2)n1
InChIInChI=1S/C14H23N3O/c1-5-15-12-9-11(14(2,3)4)16-13(17-12)10-7-6-8-18-10/h9-10H,5-8H2,1-4H3,(H,15,16,17)
InChIKeyAYOIJALGCNJBKS-UHFFFAOYSA-N
XLogP3.06
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)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

Related Compounds

N-ethyl-2-(oxolan-2-yl)-6-propylpyrimidin-4-amine
CID 65328938
6-tert-butyl-2-cycloheptyl-N-ethylpyrimidin-4-amine
CID 65399986
2,6-ditert-butyl-N-ethylpyrimidin-4-amine
CID 62192687
6-tert-butyl-N-ethyl-2-(oxolan-3-ylmethyl)pyrimidin-4-amine
CID 103987795
N-(3-ethoxypropyl)-6-methoxy-2-(oxolan-2-yl)pyrimidin-4-amine
CID 82457692
2-(oxolan-2-yl)-N-(oxolan-2-ylmethyl)-6-propoxypyrimidin-4-amine
CID 82457766
N-(2-methylpropyl)-2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine
CID 82457767
N-cyclopropyl-6-ethoxy-2-(oxolan-2-yl)pyrimidin-4-amine
CID 82457723
N-butan-2-yl-6-chloro-2-(oxolan-2-yl)pyrimidin-4-amine
CID 82463293
6-(2-methylpropoxy)-2-(oxolan-2-yl)-N-pentylpyrimidin-4-amine
CID 82457782
[6-tert-butyl-2-(oxan-3-yl)pyrimidin-4-yl]hydrazine
CID 63739487
N-[(4-fluorophenyl)methyl]-6-methoxy-2-(oxolan-2-yl)pyrimidin-4-amine
CID 82457717

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine?
The IUPAC name of 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine (CID 65328095) is 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine is CCNc1cc(C(C)(C)C)nc(C2CCCO2)n1.
What is the InChIKey of 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine?
The InChIKey is AYOIJALGCNJBKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-5-15-12-9-11(14(2,3)4)16-13(17-12)10-7-6-8-18-10/h9-10H,5-8H2,1-4H3,(H,15,16,17).
What are the key properties of 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine?
6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-N-ethyl-2-(oxolan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 65328095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).