7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide

C21H18N2O3 — CID 4187863

IUPAC7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide
SMILESCOc1ccc2cc3cc(C(=O)NCc4ccc(C)cc4)oc3nc2c1
InChIInChI=1S/C21H18N2O3/c1-13-3-5-14(6-4-13)12-22-20(24)19-10-16-9-15-7-8-17(25-2)11-18(15)23-21(16)26-19/h3-11H,12H2,1-2H3,(H,22,24)
InChIKeyRAEOYVQKZREKBW-UHFFFAOYSA-N
MW346.39 g/mol
LogP4.23
Rot. Bonds4

About 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide

7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide (PubChem CID 4187863) has the molecular formula C21H18N2O3 and a molecular weight of 346.39 g/mol. Its IUPAC name is 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide
PubChem CID4187863
Molecular FormulaC21H18N2O3
Molecular Weight346.39 g/mol
Exact Mass346.13
IUPAC Name7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide
SMILESCOc1ccc2cc3cc(C(=O)NCc4ccc(C)cc4)oc3nc2c1
InChIInChI=1S/C21H18N2O3/c1-13-3-5-14(6-4-13)12-22-20(24)19-10-16-9-15-7-8-17(25-2)11-18(15)23-21(16)26-19/h3-11H,12H2,1-2H3,(H,22,24)
InChIKeyRAEOYVQKZREKBW-UHFFFAOYSA-N
XLogP4.23
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-methyl-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide
CID 3279861
N-[(2,4-dimethoxyphenyl)methyl]-7-methylfuro[2,3-b]quinoline-2-carboxamide
CID 15994887
7-methoxy-N-[(2-methoxyphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide
CID 15990860
7-methoxy-N-[2-(3-methylphenyl)ethyl]furo[2,3-b]quinoline-2-carboxamide
CID 15996824
N-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide
CID 3240582
N-(4-methoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide
CID 22582804
N-(2,5-dimethoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide
CID 15995839
N-ethyl-N-(4-methoxyphenyl)-7-methylfuro[2,3-b]quinoline-2-carboxamide
CID 3244655
6-methoxy-N-[(2-methoxyphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide
CID 15990836
6-methoxy-N-(thiophen-2-ylmethyl)furo[2,3-b]quinoline-2-carboxamide
CID 3245490
N-(3-fluoro-4-methylphenyl)-7-methoxyfuro[2,3-b]quinoline-2-carboxamide
CID 15999992
7-methyl-N-(2-phenylethyl)furo[2,3-b]quinoline-2-carboxamide
CID 22582807

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide?
The IUPAC name of 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide (CID 4187863) is 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide.
What is the SMILES notation for 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide?
The canonical SMILES for 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide is COc1ccc2cc3cc(C(=O)NCc4ccc(C)cc4)oc3nc2c1.
What is the InChIKey of 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide?
The InChIKey is RAEOYVQKZREKBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O3/c1-13-3-5-14(6-4-13)12-22-20(24)19-10-16-9-15-7-8-17(25-2)11-18(15)23-21(16)26-19/h3-11H,12H2,1-2H3,(H,22,24).
What are the key properties of 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide?
7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide has a molecular weight of 346.39 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-[(4-methylphenyl)methyl]furo[2,3-b]quinoline-2-carboxamide is sourced from PubChem (CID 4187863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).