[1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol

C10H15BrN4O — CID 102789914

IUPAC[1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol
SMILESCC1CCN(c2nc(N)ncc2Br)C1CO
InChIInChI=1S/C10H15BrN4O/c1-6-2-3-15(8(6)5-16)9-7(11)4-13-10(12)14-9/h4,6,8,16H,2-3,5H2,1H3,(H2,12,13,14)
InChIKeyYWZPBXZKLWJOIE-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.03
Rot. Bonds2

About [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol

[1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol (PubChem CID 102789914) has the molecular formula C10H15BrN4O and a molecular weight of 287.16 g/mol. Its IUPAC name is [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol
PubChem CID102789914
Molecular FormulaC10H15BrN4O
Molecular Weight287.16 g/mol
Exact Mass286.04
IUPAC Name[1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol
SMILESCC1CCN(c2nc(N)ncc2Br)C1CO
InChIInChI=1S/C10H15BrN4O/c1-6-2-3-15(8(6)5-16)9-7(11)4-13-10(12)14-9/h4,6,8,16H,2-3,5H2,1H3,(H2,12,13,14)
InChIKeyYWZPBXZKLWJOIE-UHFFFAOYSA-N
XLogP1.03
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-4-(4-methoxy-2-methylpiperidin-1-yl)pyrimidin-2-amine
CID 114221655
[1-(2-amino-5-bromopyrimidin-4-yl)piperidin-4-yl]methanol
CID 80756578
[4-(2-amino-5-bromopyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
CID 81216804
[1-(2,5-dichloropyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol
CID 102784143
[1-(6-amino-3,5-difluoro-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol
CID 114074767
[1-(6-aminopyrazin-2-yl)-3-methylpyrrolidin-2-yl]methanol
CID 102789805
[1-(6-bromoimidazo[1,2-a]pyrazin-8-yl)-3-methylpyrrolidin-2-yl]methanol
CID 102784075
[1-[2-(ethylamino)-5-methylpyrimidin-4-yl]-3-methylpyrrolidin-2-yl]methanol
CID 102789926
[1-(4-aminophenyl)-3-methylpyrrolidin-2-yl]methanol
CID 102777231
[1-(6-bromo-2-tert-butylpyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol
CID 102784178
[(2S,3R)-1-(3-fluoro-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol
CID 129413727
[1-(2-aminophenyl)-3-methylpyrrolidin-2-yl]methanol
CID 102777296

Frequently Asked Questions

What is the IUPAC name of [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol?
The IUPAC name of [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol (CID 102789914) is [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol is CC1CCN(c2nc(N)ncc2Br)C1CO.
What is the InChIKey of [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol?
The InChIKey is YWZPBXZKLWJOIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN4O/c1-6-2-3-15(8(6)5-16)9-7(11)4-13-10(12)14-9/h4,6,8,16H,2-3,5H2,1H3,(H2,12,13,14).
What are the key properties of [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol?
[1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol has a molecular weight of 287.16 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-amino-5-bromopyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol is sourced from PubChem (CID 102789914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).