[(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol

C10H16N4O2 — CID 59474201

IUPAC[(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol
SMILESCOc1nc(C)nc(N2CCC[C@H]2CO)n1
InChIInChI=1S/C10H16N4O2/c1-7-11-9(13-10(12-7)16-2)14-5-3-4-8(14)6-15/h8,15H,3-6H2,1-2H3/t8-/m0/s1
InChIKeyFULWRVZKPGCHTM-QMMMGPOBSA-N
MW224.26 g/mol
LogP0.15
Rot. Bonds3

About [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol

[(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol (PubChem CID 59474201) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol
PubChem CID59474201
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name[(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol
SMILESCOc1nc(C)nc(N2CCC[C@H]2CO)n1
InChIInChI=1S/C10H16N4O2/c1-7-11-9(13-10(12-7)16-2)14-5-3-4-8(14)6-15/h8,15H,3-6H2,1-2H3/t8-/m0/s1
InChIKeyFULWRVZKPGCHTM-QMMMGPOBSA-N
XLogP0.15
TPSA71.37 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol?
The IUPAC name of [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol (CID 59474201) is [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol is COc1nc(C)nc(N2CCC[C@H]2CO)n1.
What is the InChIKey of [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol?
The InChIKey is FULWRVZKPGCHTM-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-7-11-9(13-10(12-7)16-2)14-5-3-4-8(14)6-15/h8,15H,3-6H2,1-2H3/t8-/m0/s1.
What are the key properties of [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol?
[(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol has a molecular weight of 224.26 g/mol, XLogP of 0.15, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 59474201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).