N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide

C24H37N5O4S — CID 4057253

IUPACN-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide
SMILESCCN(CC)CCCC(C)NC(=O)Cc1csc(NC(=O)CN(C(=O)c2ccco2)C(C)C)n1
InChIInChI=1S/C24H37N5O4S/c1-6-28(7-2)12-8-10-18(5)25-21(30)14-19-16-34-24(26-19)27-22(31)15-29(17(3)4)23(32)20-11-9-13-33-20/h9,11,13,16-18H,6-8,10,12,14-15H2,1-5H3,(H,25,30)(H,26,27,31)
InChIKeyXZOYKPFVNVVEFX-UHFFFAOYSA-N
MW491.66 g/mol
LogP3.39
Rot. Bonds14

About N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide

N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide (PubChem CID 4057253) has the molecular formula C24H37N5O4S and a molecular weight of 491.66 g/mol. Its IUPAC name is N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide
PubChem CID4057253
Molecular FormulaC24H37N5O4S
Molecular Weight491.66 g/mol
Exact Mass491.26
IUPAC NameN-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide
SMILESCCN(CC)CCCC(C)NC(=O)Cc1csc(NC(=O)CN(C(=O)c2ccco2)C(C)C)n1
InChIInChI=1S/C24H37N5O4S/c1-6-28(7-2)12-8-10-18(5)25-21(30)14-19-16-34-24(26-19)27-22(31)15-29(17(3)4)23(32)20-11-9-13-33-20/h9,11,13,16-18H,6-8,10,12,14-15H2,1-5H3,(H,25,30)(H,26,27,31)
InChIKeyXZOYKPFVNVVEFX-UHFFFAOYSA-N
XLogP3.39
TPSA107.78 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds14
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500491.66
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide with MolForge

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Related Compounds

N-[2-[[4-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide
CID 4641952
N-(2-methoxyethyl)-N-[2-oxo-2-[[4-[2-oxo-2-(propan-2-ylamino)ethyl]-1,3-thiazol-2-yl]amino]ethyl]furan-2-carboxamide
CID 4124696
4-chloro-N-[2-oxo-2-[[4-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]-1,3-thiazol-2-yl]amino]ethyl]-N-propan-2-ylbenzamide
CID 4140064
N-[2-oxo-2-[[4-[2-oxo-2-(1-phenylethylamino)ethyl]-1,3-thiazol-2-yl]amino]ethyl]-N-propan-2-ylbenzamide
CID 3502903
N-[2-[[4-[2-(dipropylamino)-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 4183857
N-[2-oxo-2-[[4-[2-oxo-2-[4-(3-phenylprop-2-enyl)piperazin-1-yl]ethyl]-1,3-thiazol-2-yl]amino]ethyl]-N-propan-2-ylfuran-2-carboxamide
CID 1030095
N-[4-[2-[(2-methyl-1-phenylpropyl)amino]-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 51213959
N-[4-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 40881647
3,4-dichloro-N-[2-[[4-[2-(furan-2-ylmethylamino)-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylbenzamide
CID 1030114
N-[2-oxo-2-[[4-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]-1,3-thiazol-2-yl]amino]ethyl]-N-propylbenzamide
CID 4609583
N-[4-[2-(1-imidazol-1-ylpropan-2-ylamino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 55740158
N-[4-[2-oxo-2-(propylamino)ethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 17472757

Frequently Asked Questions

What is the IUPAC name of N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide?
The IUPAC name of N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide (CID 4057253) is N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide.
What is the SMILES notation for N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide?
The canonical SMILES for N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide is CCN(CC)CCCC(C)NC(=O)Cc1csc(NC(=O)CN(C(=O)c2ccco2)C(C)C)n1.
What is the InChIKey of N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide?
The InChIKey is XZOYKPFVNVVEFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H37N5O4S/c1-6-28(7-2)12-8-10-18(5)25-21(30)14-19-16-34-24(26-19)27-22(31)15-29(17(3)4)23(32)20-11-9-13-33-20/h9,11,13,16-18H,6-8,10,12,14-15H2,1-5H3,(H,25,30)(H,26,27,31).
What are the key properties of N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide?
N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide has a molecular weight of 491.66 g/mol, XLogP of 3.39, 14 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[4-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide is sourced from PubChem (CID 4057253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).