1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine

C8H9ClN4 — CID 83831281

IUPAC1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine
SMILESCNCc1cnc2ncc(Cl)n2c1
InChIInChI=1S/C8H9ClN4/c1-10-2-6-3-11-8-12-4-7(9)13(8)5-6/h3-5,10H,2H2,1H3
InChIKeyIWQXEPKCRZRWGT-UHFFFAOYSA-N
MW196.64 g/mol
LogP1.10
Rot. Bonds2

About 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine

1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine (PubChem CID 83831281) has the molecular formula C8H9ClN4 and a molecular weight of 196.64 g/mol. Its IUPAC name is 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine
PubChem CID83831281
Molecular FormulaC8H9ClN4
Molecular Weight196.64 g/mol
Exact Mass196.05
IUPAC Name1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine
SMILESCNCc1cnc2ncc(Cl)n2c1
InChIInChI=1S/C8H9ClN4/c1-10-2-6-3-11-8-12-4-7(9)13(8)5-6/h3-5,10H,2H2,1H3
InChIKeyIWQXEPKCRZRWGT-UHFFFAOYSA-N
XLogP1.10
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.64
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloroimidazo[1,2-a]pyrimidine-6-carbaldehyde
CID 83828452
N-methyl-1-(6-methylimidazo[1,2-a]pyrimidin-3-yl)methanamine
CID 83827626
N-methyl-1-[2-(trichloromethyl)pyrimidin-5-yl]methanamine
CID 165466670
1-[5-chloro-6-(2,4,5-trichlorophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62296357
1-[2-(2-chlorophenyl)pyrimidin-5-yl]-N-methylmethanamine
CID 62756584
1-[5-chloro-6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]-N-methylmethanamine
CID 62291646
1-[1-(difluoromethyl)pyrazol-4-yl]-N-methylmethanamine
CID 83814748
1-(6-chloro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)-N-methylmethanamine
CID 84667940
1-(1-chloroimidazo[1,5-a]pyridin-6-yl)-N-methylmethanamine
CID 83869248
N-methyl-1-(2-piperidin-1-ylpyrimidin-5-yl)methanamine
CID 62756397
1-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-N-methylmethanamine
CID 62730298
1-(2-cyclopropylpyrimidin-5-yl)-N-methylmethanamine
CID 62756946

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine?
The IUPAC name of 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine (CID 83831281) is 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine?
The canonical SMILES for 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine is CNCc1cnc2ncc(Cl)n2c1.
What is the InChIKey of 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine?
The InChIKey is IWQXEPKCRZRWGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN4/c1-10-2-6-3-11-8-12-4-7(9)13(8)5-6/h3-5,10H,2H2,1H3.
What are the key properties of 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine?
1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine has a molecular weight of 196.64 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloroimidazo[1,2-a]pyrimidin-6-yl)-N-methylmethanamine is sourced from PubChem (CID 83831281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).