[2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol

C12H15N3O2 — CID 83184280

IUPAC[2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol
SMILESCc1nc(N(C)Cc2ccoc2)ncc1CO
InChIInChI=1S/C12H15N3O2/c1-9-11(7-16)5-13-12(14-9)15(2)6-10-3-4-17-8-10/h3-5,8,16H,6-7H2,1-2H3
InChIKeyHMALWTCPHCGDLB-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.51
Rot. Bonds4

About [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol

[2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol (PubChem CID 83184280) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol
PubChem CID83184280
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name[2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol
SMILESCc1nc(N(C)Cc2ccoc2)ncc1CO
InChIInChI=1S/C12H15N3O2/c1-9-11(7-16)5-13-12(14-9)15(2)6-10-3-4-17-8-10/h3-5,8,16H,6-7H2,1-2H3
InChIKeyHMALWTCPHCGDLB-UHFFFAOYSA-N
XLogP1.51
TPSA62.39 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 ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol?
The IUPAC name of [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol (CID 83184280) is [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol.
What is the SMILES notation for [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol?
The canonical SMILES for [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol is Cc1nc(N(C)Cc2ccoc2)ncc1CO.
What is the InChIKey of [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol?
The InChIKey is HMALWTCPHCGDLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-9-11(7-16)5-13-12(14-9)15(2)6-10-3-4-17-8-10/h3-5,8,16H,6-7H2,1-2H3.
What are the key properties of [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol?
[2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol has a molecular weight of 233.27 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol is sourced from PubChem (CID 83184280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).