8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline

C23H22N4O — CID 56704817

IUPAC8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline
SMILESCOc1ccc(-c2ccc(C3NCCc4[nH]cnc43)cc2)c2ccc(C)nc12
InChIInChI=1S/C23H22N4O/c1-14-3-8-18-17(9-10-20(28-2)22(18)27-14)15-4-6-16(7-5-15)21-23-19(11-12-24-21)25-13-26-23/h3-10,13,21,24H,11-12H2,1-2H3,(H,25,26)
InChIKeyUDBZFEYEIZXSPA-UHFFFAOYSA-N
MW370.46 g/mol
LogP4.18
Rot. Bonds3

About 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline

8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline (PubChem CID 56704817) has the molecular formula C23H22N4O and a molecular weight of 370.46 g/mol. Its IUPAC name is 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline.

Molecular Properties

Compound Name8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline
PubChem CID56704817
Molecular FormulaC23H22N4O
Molecular Weight370.46 g/mol
Exact Mass370.18
IUPAC Name8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline
SMILESCOc1ccc(-c2ccc(C3NCCc4[nH]cnc43)cc2)c2ccc(C)nc12
InChIInChI=1S/C23H22N4O/c1-14-3-8-18-17(9-10-20(28-2)22(18)27-14)15-4-6-16(7-5-15)21-23-19(11-12-24-21)25-13-26-23/h3-10,13,21,24H,11-12H2,1-2H3,(H,25,26)
InChIKeyUDBZFEYEIZXSPA-UHFFFAOYSA-N
XLogP4.18
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline with MolForge

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Related Compounds

5-{2-[4-(3H-Benzimidazol-4-ylmethyl)piperazin-1-yl]ethoxy}-2-methylquinoline
CID 10150796
N-(3-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3-yl}phenyl)pyrimidin-2-amine
CID 10288118
N-[[3-[(2-amino-4-phenylphenyl)methyl]imidazol-4-yl]methyl]-5-methoxy-6-phenylpyridin-2-amine
CID 73355620
8-(1H-benzimidazol-2-ylmethoxy)quinoline
CID 2231560
5-[(8-Methoxy-2-methyl-7-prop-2-enylquinolin-5-yl)methyl]pyrimidine-2,4-diamine
CID 12849779
5-[(8-Methoxy-7-propylquinolin-5-yl)methyl]pyrimidine-2,4-diamine
CID 12849783
N-[2-(Aminomethyl)-4-methoxybenzyl]-N-(1H-benzimidazol-2-ylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 53320374
N-[(3-pyridin-3-yloxyphenyl)methyl]-9H-pyrido[3,4-b]indol-3-amine
CID 154632636
7-(5-amino-4-methyl-3-pyridinyl)-6-fluoro-2-N-(6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)quinazoline-2,5-diamine
CID 164514616
4-(3,4-dihydroisoquinolin-2(1H)-yl)-8-methoxy-5H-pyrimido[5,4-b]indole
CID 931001
N-[2-(4-methoxyphenyl)ethyl]-5H-pyrimido[5,4-b]indol-4-amine
CID 931085
6-(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)-1H-benzo[d]imidazole
CID 10065601

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline?
The IUPAC name of 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline (CID 56704817) is 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline.
What is the SMILES notation for 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline?
The canonical SMILES for 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline is COc1ccc(-c2ccc(C3NCCc4[nH]cnc43)cc2)c2ccc(C)nc12.
What is the InChIKey of 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline?
The InChIKey is UDBZFEYEIZXSPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O/c1-14-3-8-18-17(9-10-20(28-2)22(18)27-14)15-4-6-16(7-5-15)21-23-19(11-12-24-21)25-13-26-23/h3-10,13,21,24H,11-12H2,1-2H3,(H,25,26).
What are the key properties of 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline?
8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline has a molecular weight of 370.46 g/mol, XLogP of 4.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2-methyl-5-[4-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)phenyl]quinoline is sourced from PubChem (CID 56704817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).