N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide

C21H18N2O2 — CID 3240962

IUPACN,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide
SMILESCc1cccc(N(C)C(=O)c2cc3cc4ccc(C)cc4nc3o2)c1
InChIInChI=1S/C21H18N2O2/c1-13-5-4-6-17(9-13)23(3)21(24)19-12-16-11-15-8-7-14(2)10-18(15)22-20(16)25-19/h4-12H,1-3H3
InChIKeyFCUROCKDUURPEC-UHFFFAOYSA-N
MW330.39 g/mol
LogP4.87
Rot. Bonds2

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

N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide (PubChem CID 3240962) has the molecular formula C21H18N2O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide.

Molecular Properties

Compound NameN,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide
PubChem CID3240962
Molecular FormulaC21H18N2O2
Molecular Weight330.39 g/mol
Exact Mass330.14
IUPAC NameN,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide
SMILESCc1cccc(N(C)C(=O)c2cc3cc4ccc(C)cc4nc3o2)c1
InChIInChI=1S/C21H18N2O2/c1-13-5-4-6-17(9-13)23(3)21(24)19-12-16-11-15-8-7-14(2)10-18(15)22-20(16)25-19/h4-12H,1-3H3
InChIKeyFCUROCKDUURPEC-UHFFFAOYSA-N
XLogP4.87
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide?
The IUPAC name of N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide (CID 3240962) is N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide.
What is the SMILES notation for N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide?
The canonical SMILES for N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide is Cc1cccc(N(C)C(=O)c2cc3cc4ccc(C)cc4nc3o2)c1.
What is the InChIKey of N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide?
The InChIKey is FCUROCKDUURPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O2/c1-13-5-4-6-17(9-13)23(3)21(24)19-12-16-11-15-8-7-14(2)10-18(15)22-20(16)25-19/h4-12H,1-3H3.
What are the key properties of N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide?
N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 4.87, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-dimethyl-N-(3-methylphenyl)furo[2,3-b]quinoline-2-carboxamide is sourced from PubChem (CID 3240962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).