2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride

C8H14ClN3 — CID 105442920

IUPAC2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride
SMILESCCc1cnc(CCN)nc1.Cl
InChIInChI=1S/C8H13N3.ClH/c1-2-7-5-10-8(3-4-9)11-6-7;/h5-6H,2-4,9H2,1H3;1H
InChIKeyCZPYYGXEAWZJSH-UHFFFAOYSA-N
MW187.67 g/mol
LogP0.96
Rot. Bonds3

About 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride

2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride (PubChem CID 105442920) has the molecular formula C8H14ClN3 and a molecular weight of 187.67 g/mol. Its IUPAC name is 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride
PubChem CID105442920
Molecular FormulaC8H14ClN3
Molecular Weight187.67 g/mol
Exact Mass187.09
IUPAC Name2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride
SMILESCCc1cnc(CCN)nc1.Cl
InChIInChI=1S/C8H13N3.ClH/c1-2-7-5-10-8(3-4-9)11-6-7;/h5-6H,2-4,9H2,1H3;1H
InChIKeyCZPYYGXEAWZJSH-UHFFFAOYSA-N
XLogP0.96
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.67
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-diethylpyrimidine;hydroiodide
CID 143798194
2-(5-ethyl-2-pyridinyl)ethanamine;hydrochloride
CID 76847658
2-(2,2-dimethylpropyl)-5-ethylpyrimidine
CID 146228147
2-(5-tert-butylpyrimidin-2-yl)ethanamine
CID 55263070
2-(bromomethyl)-5-ethylpyrimidine
CID 169043827
2-[2-[2-(dimethylamino)ethyl]pyrimidin-5-yl]ethanamine
CID 115347160
2-[6-(4-ethylphenyl)-3-pyridinyl]ethanamine
CID 117001771
2-chloro-5-ethylpyrimidine
CID 3572763
2-(5-phenylpyrimidin-2-yl)ethanamine
CID 63317648
2-[2-(tert-butylsulfanylmethyl)pyrimidin-5-yl]ethanamine
CID 65137662
[2-(3-methylbutyl)pyrimidin-5-yl]methanamine
CID 62757488
5-ethyl-2-[(E)-prop-1-enyl]pyrimidine
CID 145069367

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride?
The IUPAC name of 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride (CID 105442920) is 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride.
What is the SMILES notation for 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride?
The canonical SMILES for 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride is CCc1cnc(CCN)nc1.Cl.
What is the InChIKey of 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride?
The InChIKey is CZPYYGXEAWZJSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3.ClH/c1-2-7-5-10-8(3-4-9)11-6-7;/h5-6H,2-4,9H2,1H3;1H.
What are the key properties of 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride?
2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride has a molecular weight of 187.67 g/mol, XLogP of 0.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethylpyrimidin-2-yl)ethanamine;hydrochloride is sourced from PubChem (CID 105442920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).