7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline

C23H23ClN4 — CID 139938348

IUPAC7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline
SMILESClc1ccc2c(c1)ncc1nc(-c3ccccc3)n(CCC3CCNCC3)c12
InChIInChI=1S/C23H23ClN4/c24-18-6-7-19-20(14-18)26-15-21-22(19)28(13-10-16-8-11-25-12-9-16)23(27-21)17-4-2-1-3-5-17/h1-7,14-16,25H,8-13H2
InChIKeyFRSSLJGSXMQPQC-UHFFFAOYSA-N
MW390.92 g/mol
LogP5.29
Rot. Bonds4

About 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline

7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline (PubChem CID 139938348) has the molecular formula C23H23ClN4 and a molecular weight of 390.92 g/mol. Its IUPAC name is 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline
PubChem CID139938348
Molecular FormulaC23H23ClN4
Molecular Weight390.92 g/mol
Exact Mass390.16
IUPAC Name7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline
SMILESClc1ccc2c(c1)ncc1nc(-c3ccccc3)n(CCC3CCNCC3)c12
InChIInChI=1S/C23H23ClN4/c24-18-6-7-19-20(14-18)26-15-21-22(19)28(13-10-16-8-11-25-12-9-16)23(27-21)17-4-2-1-3-5-17/h1-7,14-16,25H,8-13H2
InChIKeyFRSSLJGSXMQPQC-UHFFFAOYSA-N
XLogP5.29
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.92
LogP ≤ 55.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[7-chloro-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinolin-2-yl]phenol
CID 135531253
4-chloro-8-methyl-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline
CID 18668766
7-chloro-4-methyl-2-(2-nitrophenyl)-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline
CID 10049401
4-[2-(4-chloro-2-phenylimidazol-1-yl)ethyl]piperidine
CID 174431690
3-(2-piperidin-4-ylethyl)-4-(1H-pyrrol-2-yl)-12-thia-3,5,8-triazatricyclo[7.3.0.02,6]dodeca-1,4,6,8,10-pentaene
CID 139938417
8-(4-fluorophenyl)-N-[(2-fluorophenyl)methyl]-9-(2-piperidin-4-ylethyl)purin-2-amine
CID 58155510
N-benzyl-8-(2,6-dichlorophenyl)-9-(2-piperidin-4-ylethyl)purin-2-amine
CID 58155633
2-[2-(4-chlorophenyl)ethyl]-8-(2,6-dichlorophenyl)-9-(2-piperidin-4-ylethyl)purine
CID 58155568
4-[2-(4-methyl-2-phenylimidazol-1-yl)ethyl]piperidine
CID 174445491
N-[(2-chlorophenyl)methyl]-8-(4-methylsulfonylphenyl)-9-(2-piperidin-4-ylethyl)purin-2-amine
CID 58155839
6-methyl-2-(4-methylpiperazin-1-yl)-8-phenyl-9-(2-piperidin-4-ylethyl)purine
CID 139996416
4-phenyl-3-(2-piperidin-4-ylethyl)-7-(trifluoromethyl)-3,5,8-triazatricyclo[7.3.0.02,6]dodeca-2(6),4,8-triene
CID 91610139

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline?
The IUPAC name of 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline (CID 139938348) is 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline.
What is the SMILES notation for 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline?
The canonical SMILES for 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline is Clc1ccc2c(c1)ncc1nc(-c3ccccc3)n(CCC3CCNCC3)c12.
What is the InChIKey of 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline?
The InChIKey is FRSSLJGSXMQPQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23ClN4/c24-18-6-7-19-20(14-18)26-15-21-22(19)28(13-10-16-8-11-25-12-9-16)23(27-21)17-4-2-1-3-5-17/h1-7,14-16,25H,8-13H2.
What are the key properties of 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline?
7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline has a molecular weight of 390.92 g/mol, XLogP of 5.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-phenyl-1-(2-piperidin-4-ylethyl)imidazo[4,5-c]quinoline is sourced from PubChem (CID 139938348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).