3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane

C10H13ClN2 — CID 145222637

IUPAC3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane
SMILESCC.Cc1ccc2ncc(Cl)cn12
InChIInChI=1S/C8H7ClN2.C2H6/c1-6-2-3-8-10-4-7(9)5-11(6)8;1-2/h2-5H,1H3;1-2H3
InChIKeyWEWCCIQDTQSJEY-UHFFFAOYSA-N
MW196.68 g/mol
LogP3.32
Rot. Bonds

About 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane

3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane (PubChem CID 145222637) has the molecular formula C10H13ClN2 and a molecular weight of 196.68 g/mol. Its IUPAC name is 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane.

Molecular Properties

Compound Name3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane
PubChem CID145222637
Molecular FormulaC10H13ClN2
Molecular Weight196.68 g/mol
Exact Mass196.08
IUPAC Name3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane
SMILESCC.Cc1ccc2ncc(Cl)cn12
InChIInChI=1S/C8H7ClN2.C2H6/c1-6-2-3-8-10-4-7(9)5-11(6)8;1-2/h2-5H,1H3;1-2H3
InChIKeyWEWCCIQDTQSJEY-UHFFFAOYSA-N
XLogP3.32
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane 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

3-chloro-6-methylimidazo[1,2-a]pyridine;ethane
CID 156750721
6-chloro-3-fluoroimidazo[1,2-a]pyridine
CID 138109250
N,N,3-trimethylimidazo[1,2-a]pyridin-6-amine
CID 123591892
6-chloro-3-[2-(2-methoxyethyl)pyrimidin-5-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 39817556
ethyl 7-chloro-4-oxopyrido[1,2-a]pyrimidine-3-carboxylate
CID 3932782
3-(aminomethyl)-7-chloropyrido[1,2-a]pyrimidin-4-one
CID 82507970
5-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-(4-methylphenyl)-1,2,4-oxadiazole
CID 163693237
3-bromo-6-methylimidazo[1,2-a]pyridine
CID 5260646
3,6-dichloro-[1,2,4]triazolo[4,3-a]pyridine
CID 55267539
3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine
CID 39146618
5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane
CID 164920429
(2S)-2-[(6-chloroimidazo[1,2-a]pyridin-3-yl)methylamino]propan-1-ol
CID 103773842

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane?
The IUPAC name of 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane (CID 145222637) is 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane.
What is the SMILES notation for 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane?
The canonical SMILES for 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane is CC.Cc1ccc2ncc(Cl)cn12.
What is the InChIKey of 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane?
The InChIKey is WEWCCIQDTQSJEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN2.C2H6/c1-6-2-3-8-10-4-7(9)5-11(6)8;1-2/h2-5H,1H3;1-2H3.
What are the key properties of 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane?
3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane has a molecular weight of 196.68 g/mol, XLogP of 3.32, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-methylpyrrolo[1,2-a]pyrimidine;ethane is sourced from PubChem (CID 145222637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).