4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine

C11H12N4O — CID 80864949

IUPAC4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine
SMILESNc1nccc(OCCc2ccccn2)n1
InChIInChI=1S/C11H12N4O/c12-11-14-7-4-10(15-11)16-8-5-9-3-1-2-6-13-9/h1-4,6-7H,5,8H2,(H2,12,14,15)
InChIKeyQBOTUSKNJKSXHY-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.08
Rot. Bonds4

About 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine

4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine (PubChem CID 80864949) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine
PubChem CID80864949
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC Name4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine
SMILESNc1nccc(OCCc2ccccn2)n1
InChIInChI=1S/C11H12N4O/c12-11-14-7-4-10(15-11)16-8-5-9-3-1-2-6-13-9/h1-4,6-7H,5,8H2,(H2,12,14,15)
InChIKeyQBOTUSKNJKSXHY-UHFFFAOYSA-N
XLogP1.08
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-pyridin-2-ylethoxy)pyrazin-2-amine
CID 80646671
5-methyl-4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine
CID 80865287
4-propoxypyrimidin-2-amine
CID 79002172
2-[(2-methylpropan-2-yl)oxy]-6-(2-pyridin-2-ylethoxy)pyridin-3-amine
CID 43262540
3-chloro-2-(chloromethyl)-6-(2-pyridin-2-ylethoxy)pyridine
CID 61269894
4-N-methyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
CID 80765765
[6-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]hydrazine
CID 80913517
3-(chloromethyl)-6-(2-pyridin-2-ylethoxy)pyridazine
CID 61269892
6-(2-pyridin-2-ylethoxy)pyridine-3-carbothioamide
CID 43128879
2-methyl-6-(2-pyridin-2-ylethoxy)aniline
CID 60892801
4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 80777882
2-methyl-6-(2-pyridin-2-ylethoxy)pyridine-4-carbothioamide
CID 114768153

Frequently Asked Questions

What is the IUPAC name of 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine?
The IUPAC name of 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine (CID 80864949) is 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine.
What is the SMILES notation for 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine?
The canonical SMILES for 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine is Nc1nccc(OCCc2ccccn2)n1.
What is the InChIKey of 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine?
The InChIKey is QBOTUSKNJKSXHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c12-11-14-7-4-10(15-11)16-8-5-9-3-1-2-6-13-9/h1-4,6-7H,5,8H2,(H2,12,14,15).
What are the key properties of 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine?
4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine has a molecular weight of 216.24 g/mol, XLogP of 1.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-pyridin-2-ylethoxy)pyrimidin-2-amine is sourced from PubChem (CID 80864949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).