3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine

C11H11ClN2 — CID 167521520

IUPAC3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine
SMILESC=Cc1cncc2c(Cl)cn(CC)c12
InChIInChI=1S/C11H11ClN2/c1-3-8-5-13-6-9-10(12)7-14(4-2)11(8)9/h3,5-7H,1,4H2,2H3
InChIKeyPICYZDSWMCHAEG-UHFFFAOYSA-N
MW206.68 g/mol
LogP3.35
Rot. Bonds2

About 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine

3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine (PubChem CID 167521520) has the molecular formula C11H11ClN2 and a molecular weight of 206.68 g/mol. Its IUPAC name is 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine.

Molecular Properties

Compound Name3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine
PubChem CID167521520
Molecular FormulaC11H11ClN2
Molecular Weight206.68 g/mol
Exact Mass206.06
IUPAC Name3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine
SMILESC=Cc1cncc2c(Cl)cn(CC)c12
InChIInChI=1S/C11H11ClN2/c1-3-8-5-13-6-9-10(12)7-14(4-2)11(8)9/h3,5-7H,1,4H2,2H3
InChIKeyPICYZDSWMCHAEG-UHFFFAOYSA-N
XLogP3.35
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.68
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-Chlorophenyl)indolizine
CID 346941
1-(4-Chlorophenyl)-1H-pyrrolo[2,3-c]pyridine
CID 57402656
1-[(6-Chloropyridin-3-yl)methyl]indole
CID 3805426
4-chloro-1H-pyrrolo[3,2-c]pyridine
CID 14114384
6-Chloro-1-methyl-1H-indole
CID 15335321
4,6-Dichloro-1H-pyrrolo[3,2-c]pyridine
CID 5358988
2-(3-Chlorophenyl)indolizine
CID 868222
1-benzyl-6-chloro-1H-pyrrolo(3,2-c)pyridine-7-carbonitrile
CID 12490983
6-Chloro-1H-pyrrolo(3,2-c)pyridine
CID 12575516
1-Chloro-7-methylpyrrolo[1,2-a]pyrazine
CID 14292627
7-chloro-1-methyl-1H-pyrrolo[2,3-c]pyridine
CID 59424476
4-Chloro-5,6,7-trimethyl-pyrrolo[3,4-d]pyridazine
CID 13257545

Frequently Asked Questions

What is the IUPAC name of 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine?
The IUPAC name of 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine (CID 167521520) is 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine.
What is the SMILES notation for 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine?
The canonical SMILES for 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine is C=Cc1cncc2c(Cl)cn(CC)c12.
What is the InChIKey of 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine?
The InChIKey is PICYZDSWMCHAEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2/c1-3-8-5-13-6-9-10(12)7-14(4-2)11(8)9/h3,5-7H,1,4H2,2H3.
What are the key properties of 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine?
3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine has a molecular weight of 206.68 g/mol, XLogP of 3.35, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-7-ethenyl-1-ethylpyrrolo[3,2-c]pyridine is sourced from PubChem (CID 167521520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).