[1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol

C10H16N4O — CID 10465648

IUPAC[1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol
SMILESCc1cc(N2CCC(CO)C2)nc(N)n1
InChIInChI=1S/C10H16N4O/c1-7-4-9(13-10(11)12-7)14-3-2-8(5-14)6-15/h4,8,15H,2-3,5-6H2,1H3,(H2,11,12,13)
InChIKeyKWTUPBHCIDIZBS-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.19
Rot. Bonds2

About [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol

[1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol (PubChem CID 10465648) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol
PubChem CID10465648
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name[1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol
SMILESCc1cc(N2CCC(CO)C2)nc(N)n1
InChIInChI=1S/C10H16N4O/c1-7-4-9(13-10(11)12-7)14-3-2-8(5-14)6-15/h4,8,15H,2-3,5-6H2,1H3,(H2,11,12,13)
InChIKeyKWTUPBHCIDIZBS-UHFFFAOYSA-N
XLogP0.19
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol?
The IUPAC name of [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol (CID 10465648) is [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol is Cc1cc(N2CCC(CO)C2)nc(N)n1.
What is the InChIKey of [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol?
The InChIKey is KWTUPBHCIDIZBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7-4-9(13-10(11)12-7)14-3-2-8(5-14)6-15/h4,8,15H,2-3,5-6H2,1H3,(H2,11,12,13).
What are the key properties of [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol?
[1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol has a molecular weight of 208.26 g/mol, XLogP of 0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-amino-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 10465648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).