6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine

C12H15N3O2 — CID 66328978

IUPAC6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine
SMILESCCOc1cc(NCCc2ccco2)ncn1
InChIInChI=1S/C12H15N3O2/c1-2-16-12-8-11(14-9-15-12)13-6-5-10-4-3-7-17-10/h3-4,7-9H,2,5-6H2,1H3,(H,13,14,15)
InChIKeyVPYONXWLNGYJGH-UHFFFAOYSA-N
MW233.27 g/mol
LogP2.12
Rot. Bonds6

About 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine

6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine (PubChem CID 66328978) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine
PubChem CID66328978
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine
SMILESCCOc1cc(NCCc2ccco2)ncn1
InChIInChI=1S/C12H15N3O2/c1-2-16-12-8-11(14-9-15-12)13-6-5-10-4-3-7-17-10/h3-4,7-9H,2,5-6H2,1H3,(H,13,14,15)
InChIKeyVPYONXWLNGYJGH-UHFFFAOYSA-N
XLogP2.12
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethoxy-N-[2-(furan-2-yl)ethyl]-2-methylpyrimidin-4-amine
CID 66327724
N-ethyl-6-(furan-2-ylmethoxy)pyrimidin-4-amine
CID 80858921
4-N-benzyl-6-N-[2-(furan-2-yl)ethyl]pyrimidine-4,6-diamine
CID 167864610
6-ethoxy-N-(3-phenylpropyl)pyrimidin-4-amine
CID 66328382
4-[2-[(6-ethoxypyrimidin-4-yl)amino]ethyl]phenol
CID 66330560
[6-(furan-2-ylmethoxy)pyrimidin-4-yl]hydrazine
CID 80908948
6-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyrimidin-4-amine
CID 66324894
3-[6-[2-(furan-2-yl)ethylamino]pyrimidin-4-yl]cyclobutan-1-ol
CID 91767301
5-ethyl-4-N-[2-(furan-2-yl)ethyl]-6-N-methylpyrimidine-4,6-diamine
CID 80804231
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6-ethoxypyrimidin-4-amine
CID 133464513
6-ethoxy-N-(3-methylbutyl)pyrimidin-4-amine
CID 66325707
6-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-N-(furan-2-ylmethyl)pyrimidine-4,6-diamine
CID 112858579

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine?
The IUPAC name of 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine (CID 66328978) is 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine is CCOc1cc(NCCc2ccco2)ncn1.
What is the InChIKey of 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine?
The InChIKey is VPYONXWLNGYJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-2-16-12-8-11(14-9-15-12)13-6-5-10-4-3-7-17-10/h3-4,7-9H,2,5-6H2,1H3,(H,13,14,15).
What are the key properties of 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine?
6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine has a molecular weight of 233.27 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 66328978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).