N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide

C24H30ClN3O5 — CID 3211869

IUPACN-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide
SMILESCOCCN(C(=O)CNC(=O)c1ccco1)C(C(=O)NC1CCCCC1)c1ccc(Cl)cc1
InChIInChI=1S/C24H30ClN3O5/c1-32-15-13-28(21(29)16-26-23(30)20-8-5-14-33-20)22(17-9-11-18(25)12-10-17)24(31)27-19-6-3-2-4-7-19/h5,8-12,14,19,22H,2-4,6-7,13,15-16H2,1H3,(H,26,30)(H,27,31)
InChIKeyQLSIKMDDPSYRAF-UHFFFAOYSA-N
MW475.97 g/mol
LogP3.33
Rot. Bonds10

About N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide

N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide (PubChem CID 3211869) has the molecular formula C24H30ClN3O5 and a molecular weight of 475.97 g/mol. Its IUPAC name is N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide
PubChem CID3211869
Molecular FormulaC24H30ClN3O5
Molecular Weight475.97 g/mol
Exact Mass475.19
IUPAC NameN-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide
SMILESCOCCN(C(=O)CNC(=O)c1ccco1)C(C(=O)NC1CCCCC1)c1ccc(Cl)cc1
InChIInChI=1S/C24H30ClN3O5/c1-32-15-13-28(21(29)16-26-23(30)20-8-5-14-33-20)22(17-9-11-18(25)12-10-17)24(31)27-19-6-3-2-4-7-19/h5,8-12,14,19,22H,2-4,6-7,13,15-16H2,1H3,(H,26,30)(H,27,31)
InChIKeyQLSIKMDDPSYRAF-UHFFFAOYSA-N
XLogP3.33
TPSA100.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.97
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide with MolForge

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Related Compounds

N-[2-[butyl-[(1R)-2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 40783877
N-[2-[benzyl-[(1R)-2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 40836398
N-[2-[[2-(cyclopentylamino)-2-oxo-1-(4-propan-2-ylphenyl)ethyl]-(furan-2-ylmethyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 3211555
N-[2-[[2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-(2-phenylethyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 651487
N-[2-[[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-(furan-2-ylmethyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 3211768
N-[2-[[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-prop-2-enylamino]-2-oxoethyl]furan-2-carboxamide
CID 650817
N-[2-[[2-(cyclopentylamino)-1-(4-ethylphenyl)-2-oxoethyl]-(furan-2-ylmethyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 3211562
N-[2-[[2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl]-(thiophen-2-ylmethyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 3211786
N-[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-N-(2-methoxyethyl)thiophene-2-carboxamide
CID 3202308
N-[2-[benzyl-[2-(cyclopentylamino)-1-(3-methoxyphenyl)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 3211516
N-[2-[[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxoethyl]-(oxolan-2-ylmethyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 652338
N-[2-(N-[(1S)-2-(cyclohexylamino)-1-(furan-2-yl)-2-oxoethyl]-4-methoxyanilino)-2-oxoethyl]furan-2-carboxamide
CID 40624646

Frequently Asked Questions

What is the IUPAC name of N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide?
The IUPAC name of N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide (CID 3211869) is N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide is COCCN(C(=O)CNC(=O)c1ccco1)C(C(=O)NC1CCCCC1)c1ccc(Cl)cc1.
What is the InChIKey of N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide?
The InChIKey is QLSIKMDDPSYRAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30ClN3O5/c1-32-15-13-28(21(29)16-26-23(30)20-8-5-14-33-20)22(17-9-11-18(25)12-10-17)24(31)27-19-6-3-2-4-7-19/h5,8-12,14,19,22H,2-4,6-7,13,15-16H2,1H3,(H,26,30)(H,27,31).
What are the key properties of N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide?
N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide has a molecular weight of 475.97 g/mol, XLogP of 3.33, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[1-(4-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-2-oxoethyl]furan-2-carboxamide is sourced from PubChem (CID 3211869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).