N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine

C12H15N3O2 — CID 112691697

IUPACN-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine
SMILESCOc1cc(C)nc(NC(C)c2ccco2)n1
InChIInChI=1S/C12H15N3O2/c1-8-7-11(16-3)15-12(13-8)14-9(2)10-5-4-6-17-10/h4-7,9H,1-3H3,(H,13,14,15)
InChIKeyMSNYYQFEBNJXHF-UHFFFAOYSA-N
MW233.27 g/mol
LogP2.56
Rot. Bonds4

About N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine

N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine (PubChem CID 112691697) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine
PubChem CID112691697
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC NameN-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine
SMILESCOc1cc(C)nc(NC(C)c2ccco2)n1
InChIInChI=1S/C12H15N3O2/c1-8-7-11(16-3)15-12(13-8)14-9(2)10-5-4-6-17-10/h4-7,9H,1-3H3,(H,13,14,15)
InChIKeyMSNYYQFEBNJXHF-UHFFFAOYSA-N
XLogP2.56
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-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-[1-(furan-2-yl)ethyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 66325662
N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80907427
4-methoxy-6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]pyrimidin-2-amine
CID 112691799
2-[(4-methoxy-6-methylpyrimidin-2-yl)amino]-3-methylbutan-1-ol
CID 112638162
2-[(4-methoxy-6-methylpyrimidin-2-yl)amino]-2-phenylethanol
CID 112691748
N-(dicyclopropylmethyl)-4-methoxy-6-methylpyrimidin-2-amine
CID 112691713
N-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethyl]-1-(furan-2-yl)ethanamine
CID 62582277
N-[4-[1-(furan-2-yl)ethylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide
CID 59874367
4-methoxy-6-methyl-N-(1-methylsulfanylbutan-2-yl)pyrimidin-2-amine
CID 115899319
1-(furan-2-yl)-N-[1-(2,4,6-trimethyl-3-pyridinyl)ethyl]ethanamine
CID 43776788
2-N-[1-(furan-2-yl)ethyl]-6-methoxypyridine-2,5-diamine
CID 43535632
2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 80773788

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine (CID 112691697) is N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine is COc1cc(C)nc(NC(C)c2ccco2)n1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine?
The InChIKey is MSNYYQFEBNJXHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-8-7-11(16-3)15-12(13-8)14-9(2)10-5-4-6-17-10/h4-7,9H,1-3H3,(H,13,14,15).
What are the key properties of N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine?
N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine has a molecular weight of 233.27 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine is sourced from PubChem (CID 112691697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).