[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol

C11H17N3O — CID 62373112

IUPAC[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol
SMILESCc1cc(C)nc(N2CCC(CO)C2)n1
InChIInChI=1S/C11H17N3O/c1-8-5-9(2)13-11(12-8)14-4-3-10(6-14)7-15/h5,10,15H,3-4,6-7H2,1-2H3
InChIKeyVXJLDRSPDWHICB-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.91
Rot. Bonds2

About [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol

[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol (PubChem CID 62373112) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol
PubChem CID62373112
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol
SMILESCc1cc(C)nc(N2CCC(CO)C2)n1
InChIInChI=1S/C11H17N3O/c1-8-5-9(2)13-11(12-8)14-4-3-10(6-14)7-15/h5,10,15H,3-4,6-7H2,1-2H3
InChIKeyVXJLDRSPDWHICB-UHFFFAOYSA-N
XLogP0.91
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(3S)-1-(4-chloro-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol
CID 86329185
[1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol
CID 69451869
(3R)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-amine
CID 71638298
[1-(2-chloro-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol
CID 71634268
4,6-dimethyl-2-[3-(propoxymethyl)pyrrolidin-1-yl]pyrimidine
CID 131938332
N-[[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]methyl]ethanamine
CID 62592824
2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]acetic acid
CID 66509632
4-[3-(hydroxymethyl)pyrrolidin-1-yl]-2,6-dimethylpyridine-3-carbothioamide
CID 112625491
[(3R)-1-(6-chloro-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol
CID 129393742
2-[1-(4-cyano-6-methylpyrimidin-2-yl)pyrrolidin-3-yl]acetic acid
CID 107543051
N-[[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methyl]-N-ethyl-2,2,2-trifluoroethanamine
CID 122156249
N-[[(3R)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methyl]-N-ethyl-2,2,2-trifluoroethanamine
CID 125135546

Frequently Asked Questions

What is the IUPAC name of [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol?
The IUPAC name of [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol (CID 62373112) is [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol is Cc1cc(C)nc(N2CCC(CO)C2)n1.
What is the InChIKey of [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol?
The InChIKey is VXJLDRSPDWHICB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-5-9(2)13-11(12-8)14-4-3-10(6-14)7-15/h5,10,15H,3-4,6-7H2,1-2H3.
What are the key properties of [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol?
[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol has a molecular weight of 207.28 g/mol, XLogP of 0.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 62373112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).