2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide

C25H26N4O5 — CID 24759093

IUPAC2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
SMILESCCc1cn[nH]c1NC(=O)Cc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cc1OC
InChIInChI=1S/C25H26N4O5/c1-5-15-14-27-29-25(15)28-24(30)10-16-6-7-17(11-21(16)31-2)34-20-8-9-26-19-13-23(33-4)22(32-3)12-18(19)20/h6-9,11-14H,5,10H2,1-4H3,(H2,27,28,29,30)
InChIKeyFSWYVVRVGRVNPG-UHFFFAOYSA-N
MW462.51 g/mol
LogP4.52
Rot. Bonds9

About 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide

2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide (PubChem CID 24759093) has the molecular formula C25H26N4O5 and a molecular weight of 462.51 g/mol. Its IUPAC name is 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
PubChem CID24759093
Molecular FormulaC25H26N4O5
Molecular Weight462.51 g/mol
Exact Mass462.19
IUPAC Name2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
SMILESCCc1cn[nH]c1NC(=O)Cc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cc1OC
InChIInChI=1S/C25H26N4O5/c1-5-15-14-27-29-25(15)28-24(30)10-16-6-7-17(11-21(16)31-2)34-20-8-9-26-19-13-23(33-4)22(32-3)12-18(19)20/h6-9,11-14H,5,10H2,1-4H3,(H2,27,28,29,30)
InChIKeyFSWYVVRVGRVNPG-UHFFFAOYSA-N
XLogP4.52
TPSA107.59 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.51
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(1,3-dimethylpyrazol-4-yl)acetamide
CID 24759091
2-(3,4-dimethoxyphenyl)-N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide
CID 152648895
N-(5-ethyl-1,2-oxazol-3-yl)-2-[2-methoxy-4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide
CID 24826072
[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamic acid
CID 22936459
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[4-(6-fluoroquinolin-4-yl)oxy-2-methoxyphenyl]acetamide
CID 24759202
4-[4-[2-[(4,5-dimethyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-3-methoxyphenoxy]-7-methoxy-N-methylquinoline-6-carboxamide
CID 24759206
N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-1-yl]-2-phenylacetamide
CID 59813522
4-(6,7-dimethoxyquinolin-4-yl)oxybenzoic acid
CID 22132796
1-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-3-(4-fluorophenyl)urea
CID 69321364
1-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-3-methylurea
CID 23084603
N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide
CID 54359484
1-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-5-(4-methylphenyl)pentane-2,4-dione
CID 58249515

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
The IUPAC name of 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide (CID 24759093) is 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
The canonical SMILES for 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide is CCc1cn[nH]c1NC(=O)Cc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cc1OC.
What is the InChIKey of 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
The InChIKey is FSWYVVRVGRVNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O5/c1-5-15-14-27-29-25(15)28-24(30)10-16-6-7-17(11-21(16)31-2)34-20-8-9-26-19-13-23(33-4)22(32-3)12-18(19)20/h6-9,11-14H,5,10H2,1-4H3,(H2,27,28,29,30).
What are the key properties of 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide has a molecular weight of 462.51 g/mol, XLogP of 4.52, 9 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methoxyphenyl]-N-(4-ethyl-1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 24759093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).