(2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol

C7H11N3O — CID 96635522

IUPAC(2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol
SMILESCc1ncncc1[C@@H](N)CO
InChIInChI=1S/C7H11N3O/c1-5-6(7(8)3-11)2-9-4-10-5/h2,4,7,11H,3,8H2,1H3/t7-/m0/s1
InChIKeyLYFKQJRBEWPZSK-ZETCQYMHSA-N
MW153.18 g/mol
LogP-0.22
Rot. Bonds2

About (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol

(2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol (PubChem CID 96635522) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol.

Molecular Properties

Compound Name(2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol
PubChem CID96635522
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name(2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol
SMILESCc1ncncc1[C@@H](N)CO
InChIInChI=1S/C7H11N3O/c1-5-6(7(8)3-11)2-9-4-10-5/h2,4,7,11H,3,8H2,1H3/t7-/m0/s1
InChIKeyLYFKQJRBEWPZSK-ZETCQYMHSA-N
XLogP-0.22
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol?
The IUPAC name of (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol (CID 96635522) is (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol.
What is the SMILES notation for (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol?
The canonical SMILES for (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol is Cc1ncncc1[C@@H](N)CO.
What is the InChIKey of (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol?
The InChIKey is LYFKQJRBEWPZSK-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H11N3O/c1-5-6(7(8)3-11)2-9-4-10-5/h2,4,7,11H,3,8H2,1H3/t7-/m0/s1.
What are the key properties of (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol?
(2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol has a molecular weight of 153.18 g/mol, XLogP of -0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol is sourced from PubChem (CID 96635522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).