6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine

C13H17N3O2 — CID 80966171

IUPAC6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCNc1cc(OCc2ccco2)nc(C(C)C)n1
InChIInChI=1S/C13H17N3O2/c1-9(2)13-15-11(14-3)7-12(16-13)18-8-10-5-4-6-17-10/h4-7,9H,8H2,1-3H3,(H,14,15,16)
InChIKeyCPDUGEFSSCLKJV-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.81
Rot. Bonds5

About 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine

6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 80966171) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID80966171
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCNc1cc(OCc2ccco2)nc(C(C)C)n1
InChIInChI=1S/C13H17N3O2/c1-9(2)13-15-11(14-3)7-12(16-13)18-8-10-5-4-6-17-10/h4-7,9H,8H2,1-3H3,(H,14,15,16)
InChIKeyCPDUGEFSSCLKJV-UHFFFAOYSA-N
XLogP2.81
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-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

6-(furan-2-ylmethoxy)-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 80989526
4-N-ethyl-6-(furan-2-ylmethoxy)pyrimidine-2,4-diamine
CID 80858205
6-(furan-2-ylmethoxy)-2-methyl-N-propylpyrimidin-4-amine
CID 80858748
6-(furan-2-yl)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80952634
N-methyl-6-(2,2,3,3,3-pentafluoropropoxy)-2-propan-2-ylpyrimidin-4-amine
CID 80963004
[6-(furan-2-ylmethoxy)pyrimidin-4-yl]hydrazine
CID 80908948
N-ethyl-6-(furan-2-ylmethoxy)pyrimidin-4-amine
CID 80858921
N-methyl-6-(oxolan-2-ylmethoxy)-2-propan-2-ylpyrimidin-4-amine
CID 80965962
N-methyl-2-propan-2-yl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
CID 80962688
[6-[(4-chlorophenyl)methoxy]-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80980065
6-N-ethyl-4-N-[2-(furan-2-yl)ethyl]-2-propan-2-ylpyrimidine-4,6-diamine
CID 80962187
[2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol
CID 80962451

Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine (CID 80966171) is 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine is CNc1cc(OCc2ccco2)nc(C(C)C)n1.
What is the InChIKey of 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is CPDUGEFSSCLKJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-9(2)13-15-11(14-3)7-12(16-13)18-8-10-5-4-6-17-10/h4-7,9H,8H2,1-3H3,(H,14,15,16).
What are the key properties of 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine?
6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 247.30 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80966171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).