2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine

C14H19N3O3 — CID 82454475

IUPAC2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine
SMILESCCc1nc(NCc2ccco2)cc(OCCOC)n1
InChIInChI=1S/C14H19N3O3/c1-3-12-16-13(15-10-11-5-4-6-19-11)9-14(17-12)20-8-7-18-2/h4-6,9H,3,7-8,10H2,1-2H3,(H,15,16,17)
InChIKeyTWQQYQRDHLDNOZ-UHFFFAOYSA-N
MW277.32 g/mol
LogP2.27
Rot. Bonds8

About 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine

2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine (PubChem CID 82454475) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine
PubChem CID82454475
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine
SMILESCCc1nc(NCc2ccco2)cc(OCCOC)n1
InChIInChI=1S/C14H19N3O3/c1-3-12-16-13(15-10-11-5-4-6-19-11)9-14(17-12)20-8-7-18-2/h4-6,9H,3,7-8,10H2,1-2H3,(H,15,16,17)
InChIKeyTWQQYQRDHLDNOZ-UHFFFAOYSA-N
XLogP2.27
TPSA69.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)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-(furan-2-ylmethyl)-6-(2-methoxyethoxy)-2-(methoxymethyl)pyrimidin-4-amine
CID 82456733
N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)-2-(2-methylpropyl)pyrimidin-4-amine
CID 82458125
2-tert-butyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine
CID 82456929
2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine
CID 80937643
6-butoxy-2-cyclopropyl-N-(furan-2-ylmethyl)pyrimidin-4-amine
CID 82456516
2-ethyl-6-(3-methoxypropoxy)-N-propylpyrimidin-4-amine
CID 80941336
6-(2-methoxyethoxy)-N-methyl-2-propylpyrimidin-4-amine
CID 80949765
6-(2-methoxyethoxy)-2-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 82456721
N-benzyl-2-ethyl-6-methoxypyrimidin-4-amine
CID 82453753
6-N-ethyl-4-N-(furan-2-ylmethyl)-2-methylsulfanylpyrimidine-4,6-diamine
CID 80765455
4-N-ethyl-6-(furan-2-ylmethoxy)pyrimidine-2,4-diamine
CID 80858205
6-ethoxy-N-[2-(furan-2-yl)ethyl]-2-methylpyrimidin-4-amine
CID 66327724

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine?
The IUPAC name of 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine (CID 82454475) is 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine?
The canonical SMILES for 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine is CCc1nc(NCc2ccco2)cc(OCCOC)n1.
What is the InChIKey of 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine?
The InChIKey is TWQQYQRDHLDNOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-3-12-16-13(15-10-11-5-4-6-19-11)9-14(17-12)20-8-7-18-2/h4-6,9H,3,7-8,10H2,1-2H3,(H,15,16,17).
What are the key properties of 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine?
2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine has a molecular weight of 277.32 g/mol, XLogP of 2.27, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine is sourced from PubChem (CID 82454475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).