7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline

C16H11ClN4 — CID 169001733

IUPAC7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline
SMILESClc1ccc2c(-n3ccnc3)cc(-c3cc[nH]c3)nc2c1
InChIInChI=1S/C16H11ClN4/c17-12-1-2-13-15(7-12)20-14(11-3-4-18-9-11)8-16(13)21-6-5-19-10-21/h1-10,18H
InChIKeyGFQWTDIQRSMHLG-UHFFFAOYSA-N
MW294.75 g/mol
LogP4.07
Rot. Bonds2

About 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline

7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline (PubChem CID 169001733) has the molecular formula C16H11ClN4 and a molecular weight of 294.75 g/mol. Its IUPAC name is 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline.

Molecular Properties

Compound Name7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline
PubChem CID169001733
Molecular FormulaC16H11ClN4
Molecular Weight294.75 g/mol
Exact Mass294.07
IUPAC Name7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline
SMILESClc1ccc2c(-n3ccnc3)cc(-c3cc[nH]c3)nc2c1
InChIInChI=1S/C16H11ClN4/c17-12-1-2-13-15(7-12)20-14(11-3-4-18-9-11)8-16(13)21-6-5-19-10-21/h1-10,18H
InChIKeyGFQWTDIQRSMHLG-UHFFFAOYSA-N
XLogP4.07
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.75
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(7-chloro-4-imidazol-1-ylquinolin-2-yl)-5-hydroxybenzoic acid
CID 162751496
4-(7-chloro-4-imidazol-1-ylquinolin-2-yl)thiophene-2-carboxylic acid
CID 162750674
3-(7-chloro-4-imidazol-1-ylquinolin-2-yl)-5-methoxybenzoic acid
CID 162751512
5-(7-chloro-4-imidazol-1-ylquinolin-2-yl)-2-ethoxybenzoic acid
CID 162750155
5-(7-chloro-4-imidazol-1-ylquinolin-2-yl)-2-(2-hydroxyethoxy)benzoic acid
CID 162750219
(3S)-1-(7-chloro-4-imidazol-1-ylquinolin-2-yl)piperidine-3-carboxylic acid
CID 162750277
4-chloro-7-ethenyl-2-(1H-pyrrol-3-yl)quinoline
CID 145292318
7-bromo-4-imidazol-1-yl-2-thiophen-2-ylquinoline
CID 162750467
N-[(5-chloro-2-imidazol-1-ylphenyl)methyl]cyclopropanamine
CID 114854126
azane;4-chlorocyclopropa[b]indole
CID 174412946
N-[(5-chloro-2-imidazol-1-ylphenyl)methyl]propan-2-amine
CID 114854134
7-chloro-N-(3-imidazol-1-ylpropyl)-2-phenylquinazolin-4-amine
CID 68862663

Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline?
The IUPAC name of 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline (CID 169001733) is 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline.
What is the SMILES notation for 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline?
The canonical SMILES for 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline is Clc1ccc2c(-n3ccnc3)cc(-c3cc[nH]c3)nc2c1.
What is the InChIKey of 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline?
The InChIKey is GFQWTDIQRSMHLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN4/c17-12-1-2-13-15(7-12)20-14(11-3-4-18-9-11)8-16(13)21-6-5-19-10-21/h1-10,18H.
What are the key properties of 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline?
7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline has a molecular weight of 294.75 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-4-imidazol-1-yl-2-(1H-pyrrol-3-yl)quinoline is sourced from PubChem (CID 169001733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).