7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine

C15H13ClN2 — CID 15662063

IUPAC7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine
SMILESClc1cc2c(CCc3ccccc3)nccn2c1
InChIInChI=1S/C15H13ClN2/c16-13-10-15-14(17-8-9-18(15)11-13)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2
InChIKeyJRSOZEWYXNZBOO-UHFFFAOYSA-N
MW256.74 g/mol
LogP3.77
Rot. Bonds3

About 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine

7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine (PubChem CID 15662063) has the molecular formula C15H13ClN2 and a molecular weight of 256.74 g/mol. Its IUPAC name is 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine
PubChem CID15662063
Molecular FormulaC15H13ClN2
Molecular Weight256.74 g/mol
Exact Mass256.08
IUPAC Name7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine
SMILESClc1cc2c(CCc3ccccc3)nccn2c1
InChIInChI=1S/C15H13ClN2/c16-13-10-15-14(17-8-9-18(15)11-13)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2
InChIKeyJRSOZEWYXNZBOO-UHFFFAOYSA-N
XLogP3.77
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.74
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[7-ethylsulfanyl-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine
CID 15662150
(6-chloroimidazo[1,2-a]pyridin-8-yl)methanol
CID 130065309
benzene;2-phenylethylbenzene
CID 18982764
3-(2-phenylethyl)-1-(2,4,6-trichlorophenyl)indazole
CID 57380004
6,8-dibromo-7-methyl-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine
CID 15662103
2-[2-(2-phenylethyl)imidazol-1-yl]ethanamine
CID 82558268
1-benzyl-2-chloroimidazole
CID 11629752
4-methyl-2-(2-phenylethyl)pyridin-3-amine
CID 158413024
hafnium;2-phenylethylbenzene
CID 173109801
1-[(3,4-dichlorophenyl)methyl]-2,3-dimethyl-7-(2-phenylethyl)pyrrolo[2,3-c]pyridine
CID 67142155
1-[(4-chlorophenyl)methyl]-4-(2-phenylethyl)imidazole
CID 67751239
3-(4-chlorophenyl)-2-[2-(4-chlorophenyl)ethyl]pyridine
CID 57322470

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine?
The IUPAC name of 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine (CID 15662063) is 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine.
What is the SMILES notation for 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine?
The canonical SMILES for 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine is Clc1cc2c(CCc3ccccc3)nccn2c1.
What is the InChIKey of 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine?
The InChIKey is JRSOZEWYXNZBOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2/c16-13-10-15-14(17-8-9-18(15)11-13)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2.
What are the key properties of 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine?
7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine has a molecular weight of 256.74 g/mol, XLogP of 3.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1-(2-phenylethyl)pyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 15662063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).