1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol

C10H16N4O — CID 80823336

IUPAC1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol
SMILESCc1nc(N)c(C)c(N2CCC(O)C2)n1
InChIInChI=1S/C10H16N4O/c1-6-9(11)12-7(2)13-10(6)14-4-3-8(15)5-14/h8,15H,3-5H2,1-2H3,(H2,11,12,13)
InChIKeyVOVRKMDKUCTJAP-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.25
Rot. Bonds1

About 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol

1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol (PubChem CID 80823336) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol
PubChem CID80823336
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol
SMILESCc1nc(N)c(C)c(N2CCC(O)C2)n1
InChIInChI=1S/C10H16N4O/c1-6-9(11)12-7(2)13-10(6)14-4-3-8(15)5-14/h8,15H,3-5H2,1-2H3,(H2,11,12,13)
InChIKeyVOVRKMDKUCTJAP-UHFFFAOYSA-N
XLogP0.25
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3-methoxy-4-methylpiperidin-1-yl)-2,5-dimethylpyrimidin-4-amine
CID 102971402
6-(3-methoxypyrrolidin-1-yl)-2,5-dimethylpyrimidin-4-amine
CID 103541817
1-(6-chloro-2,5-dimethylpyrimidin-4-yl)piperidin-4-ol
CID 63735099
6-(3-ethyl-4-methylpiperazin-1-yl)-2,5-dimethylpyrimidin-4-amine
CID 80834206
(3R)-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpyrimidin-4-yl]pyrrolidin-3-ol
CID 167833801
1-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidin-3-ol
CID 81006896
1-[5,6-diamino-2-(tert-butylamino)pyrimidin-4-yl]pyrrolidin-3-ol
CID 123475270
1-(5-amino-3-methyl-2-pyridinyl)pyrrolidin-3-ol
CID 62918540
1-(6-amino-2,5-dimethylpyrimidin-4-yl)-4-methylazepan-4-ol
CID 107409067
1-[2,5-dimethyl-6-(propylamino)pyrimidin-4-yl]piperidin-3-ol
CID 80779109
4-[(3S)-3-hydroxypyrrolidin-1-yl]-2-methyl-6,7-dihydro-5H-pyrido[3,4-d]pyrimidin-8-one
CID 171388187
1-(6-hydrazinyl-2-methylpyrimidin-4-yl)pyrrolidin-3-ol
CID 80919413

Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol?
The IUPAC name of 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol (CID 80823336) is 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol.
What is the SMILES notation for 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol?
The canonical SMILES for 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol is Cc1nc(N)c(C)c(N2CCC(O)C2)n1.
What is the InChIKey of 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol?
The InChIKey is VOVRKMDKUCTJAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-6-9(11)12-7(2)13-10(6)14-4-3-8(15)5-14/h8,15H,3-5H2,1-2H3,(H2,11,12,13).
What are the key properties of 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol?
1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol has a molecular weight of 208.26 g/mol, XLogP of 0.25, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-2,5-dimethylpyrimidin-4-yl)pyrrolidin-3-ol is sourced from PubChem (CID 80823336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).