N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide

C29H26N4O3 — CID 53383330

IUPACN-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide
SMILESO=C(NC1CCCCC1)C(c1ccnc2ccccc12)n1c(=O)c(-c2ccco2)nc2ccccc21
InChIInChI=1S/C29H26N4O3/c34-28(31-19-9-2-1-3-10-19)27(21-16-17-30-22-12-5-4-11-20(21)22)33-24-14-7-6-13-23(24)32-26(29(33)35)25-15-8-18-36-25/h4-8,11-19,27H,1-3,9-10H2,(H,31,34)
InChIKeyNKWAKSKXGBMTML-UHFFFAOYSA-N
MW478.55 g/mol
LogP5.24
Rot. Bonds5

About N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide

N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide (PubChem CID 53383330) has the molecular formula C29H26N4O3 and a molecular weight of 478.55 g/mol. Its IUPAC name is N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide
PubChem CID53383330
Molecular FormulaC29H26N4O3
Molecular Weight478.55 g/mol
Exact Mass478.20
IUPAC NameN-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide
SMILESO=C(NC1CCCCC1)C(c1ccnc2ccccc12)n1c(=O)c(-c2ccco2)nc2ccccc21
InChIInChI=1S/C29H26N4O3/c34-28(31-19-9-2-1-3-10-19)27(21-16-17-30-22-12-5-4-11-20(21)22)33-24-14-7-6-13-23(24)32-26(29(33)35)25-15-8-18-36-25/h4-8,11-19,27H,1-3,9-10H2,(H,31,34)
InChIKeyNKWAKSKXGBMTML-UHFFFAOYSA-N
XLogP5.24
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.55
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide with MolForge

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Related Compounds

2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-N-(4-methoxyphenyl)-2-quinolin-4-ylacetamide
CID 53383349
N,2-dicyclohexyl-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
CID 68694561
N-cyclohexyl-2-(6-methyl-2-pyridinyl)-2-(2-oxo-3-phenylquinoxalin-1-yl)acetamide
CID 11751355
N-cyclopentyl-2,3-bis(furan-2-yl)quinoxaline-6-carboxamide
CID 3236343
N-cyclopropyl-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
CID 17033311
1-[1H-benzimidazol-2-yl(pyridin-2-yl)methyl]-3-(furan-2-yl)quinoxalin-2-one
CID 53383495
N,2-dicyclohexyl-2-(2-phenylbenzimidazol-1-yl)acetamide
CID 68689707
N-cyclopentyl-2-(2-cyclopentylbenzimidazol-1-yl)-2-cyclopropylacetamide
CID 53383208
N,2-dicyclohexyl-2-[2-(4-methoxyphenyl)benzimidazol-1-yl]acetamide
CID 68694070
N-cyclopentyl-2-(2-cyclopropylbenzimidazol-1-yl)butanamide
CID 53383203
N-cyclohexyl-2-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]indol-1-yl]acetamide
CID 42111256
N,2-dicyclohexyl-2-[2-(5-methyl-1,2-oxazol-4-yl)benzimidazol-1-yl]acetamide
CID 68693676

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide?
The IUPAC name of N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide (CID 53383330) is N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide.
What is the SMILES notation for N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide?
The canonical SMILES for N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide is O=C(NC1CCCCC1)C(c1ccnc2ccccc12)n1c(=O)c(-c2ccco2)nc2ccccc21.
What is the InChIKey of N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide?
The InChIKey is NKWAKSKXGBMTML-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N4O3/c34-28(31-19-9-2-1-3-10-19)27(21-16-17-30-22-12-5-4-11-20(21)22)33-24-14-7-6-13-23(24)32-26(29(33)35)25-15-8-18-36-25/h4-8,11-19,27H,1-3,9-10H2,(H,31,34).
What are the key properties of N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide?
N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide has a molecular weight of 478.55 g/mol, XLogP of 5.24, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-2-quinolin-4-ylacetamide is sourced from PubChem (CID 53383330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).