1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine

C12H12ClN3 — CID 96597401

IUPAC1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
SMILESClc1ccccc1-c1ncn2c1CNCC2
InChIInChI=1S/C12H12ClN3/c13-10-4-2-1-3-9(10)12-11-7-14-5-6-16(11)8-15-12/h1-4,8,14H,5-7H2
InChIKeyWAMJNXYUPVHCLT-UHFFFAOYSA-N
MW233.70 g/mol
LogP2.31
Rot. Bonds1

About 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine

1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine (PubChem CID 96597401) has the molecular formula C12H12ClN3 and a molecular weight of 233.70 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
PubChem CID96597401
Molecular FormulaC12H12ClN3
Molecular Weight233.70 g/mol
Exact Mass233.07
IUPAC Name1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
SMILESClc1ccccc1-c1ncn2c1CNCC2
InChIInChI=1S/C12H12ClN3/c13-10-4-2-1-3-9(10)12-11-7-14-5-6-16(11)8-15-12/h1-4,8,14H,5-7H2
InChIKeyWAMJNXYUPVHCLT-UHFFFAOYSA-N
XLogP2.31
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.70
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-chlorophenyl)methyl]-N-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide
CID 167935867
4-(2-chlorophenyl)-5-piperazin-1-ylpyrimidin-2-amine
CID 117211243
3-bromo-2-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 83904556
methyl 5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxylate
CID 68508140
5-(2-chlorophenyl)-3-ethylimidazol-4-amine
CID 62018842
1-(2-chlorophenyl)piperazine
CID 162116490
(6R)-1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-6-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 125128690
3-chloro-2-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 82653371
1-(2-chlorophenyl)piperazine;dihydrochloride
CID 3018683
5-(2-chlorophenyl)-3-propylimidazol-4-amine
CID 62017724
2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride
CID 156786860
4-chloro-6-piperazin-1-ylbenzo[b][1,4]benzothiazepine
CID 91439010

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The IUPAC name of 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine (CID 96597401) is 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine.
What is the SMILES notation for 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The canonical SMILES for 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine is Clc1ccccc1-c1ncn2c1CNCC2.
What is the InChIKey of 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The InChIKey is WAMJNXYUPVHCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3/c13-10-4-2-1-3-9(10)12-11-7-14-5-6-16(11)8-15-12/h1-4,8,14H,5-7H2.
What are the key properties of 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine has a molecular weight of 233.70 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine is sourced from PubChem (CID 96597401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).