2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine

C11H12N4 — CID 83847964

IUPAC2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine
SMILESNCCc1cc(-c2ccncc2)ncn1
InChIInChI=1S/C11H12N4/c12-4-1-10-7-11(15-8-14-10)9-2-5-13-6-3-9/h2-3,5-8H,1,4,12H2
InChIKeySFKVRYUVXQMDGL-UHFFFAOYSA-N
MW200.25 g/mol
LogP1.04
Rot. Bonds3

About 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine

2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine (PubChem CID 83847964) has the molecular formula C11H12N4 and a molecular weight of 200.25 g/mol. Its IUPAC name is 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine
PubChem CID83847964
Molecular FormulaC11H12N4
Molecular Weight200.25 g/mol
Exact Mass200.11
IUPAC Name2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine
SMILESNCCc1cc(-c2ccncc2)ncn1
InChIInChI=1S/C11H12N4/c12-4-1-10-7-11(15-8-14-10)9-2-5-13-6-3-9/h2-3,5-8H,1,4,12H2
InChIKeySFKVRYUVXQMDGL-UHFFFAOYSA-N
XLogP1.04
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.25
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[6-(4-chlorophenyl)pyrimidin-4-yl]ethanamine
CID 83850617
2-[6-(4-fluorophenyl)pyrimidin-4-yl]ethanamine
CID 83849204
(6-pyridin-3-ylpyrimidin-4-yl)methanamine
CID 82405865
[6-(4-bromophenyl)pyrimidin-4-yl]methanamine;hydrochloride
CID 82022750
4-phenyl-6-propylpyrimidine
CID 13153439
4-butyl-6-phenylpyrimidine
CID 71620017
[6-(4-cyclopropylphenyl)pyrimidin-4-yl]methanamine
CID 118008230
ethyl 6-pyridin-4-ylpyrimidine-4-carboxylate
CID 122239334
(4-pyrimidin-4-ylphenyl)methanamine
CID 28815273
(5-ethoxy-2-pyridin-4-yl-4-pyridinyl)methanamine
CID 132588994
1-(6-pyridin-3-ylpyrimidin-4-yl)propan-2-amine
CID 83849087
ethane;[6-[4-(trifluoromethylsulfanyl)phenyl]pyrimidin-4-yl]methanamine
CID 144826439

Frequently Asked Questions

What is the IUPAC name of 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine?
The IUPAC name of 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine (CID 83847964) is 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine.
What is the SMILES notation for 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine?
The canonical SMILES for 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine is NCCc1cc(-c2ccncc2)ncn1.
What is the InChIKey of 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine?
The InChIKey is SFKVRYUVXQMDGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4/c12-4-1-10-7-11(15-8-14-10)9-2-5-13-6-3-9/h2-3,5-8H,1,4,12H2.
What are the key properties of 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine?
2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine has a molecular weight of 200.25 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-pyridin-4-ylpyrimidin-4-yl)ethanamine is sourced from PubChem (CID 83847964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).