3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide

C24H26N2O3 — CID 43040064

IUPAC3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide
SMILESCC(=O)NC(CC(=O)N(Cc1ccco1)c1ccc(C)cc1)c1ccc(C)cc1
InChIInChI=1S/C24H26N2O3/c1-17-6-10-20(11-7-17)23(25-19(3)27)15-24(28)26(16-22-5-4-14-29-22)21-12-8-18(2)9-13-21/h4-14,23H,15-16H2,1-3H3,(H,25,27)
InChIKeySKIOEYGLOITXRN-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.70
Rot. Bonds7

About 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide

3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide (PubChem CID 43040064) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide.

Molecular Properties

Compound Name3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide
PubChem CID43040064
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC Name3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide
SMILESCC(=O)NC(CC(=O)N(Cc1ccco1)c1ccc(C)cc1)c1ccc(C)cc1
InChIInChI=1S/C24H26N2O3/c1-17-6-10-20(11-7-17)23(25-19(3)27)15-24(28)26(16-22-5-4-14-29-22)21-12-8-18(2)9-13-21/h4-14,23H,15-16H2,1-3H3,(H,25,27)
InChIKeySKIOEYGLOITXRN-UHFFFAOYSA-N
XLogP4.70
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-acetamido-3-(4-chlorophenyl)-N-(furan-2-ylmethyl)-N-(4-methylphenyl)propanamide
CID 55495044
N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide
CID 60528113
3-acetamido-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-3-phenylpropanamide
CID 78798556
(3R)-3-acetamido-3-(4-methylphenyl)propanoic acid
CID 25323198
2-[(4-chlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-(4-methylphenyl)acetamide
CID 1167420
3-acetamido-3-(4-methylphenyl)-N,N-bis(prop-2-enyl)propanamide
CID 75854684
3,5-difluoro-N-(furan-2-ylmethyl)-N-(4-methylphenyl)benzamide
CID 18226162
3-acetamido-N-benzyl-3-(4-chlorophenyl)-N-(4-methoxyphenyl)propanamide
CID 134012020
N-(furan-2-ylmethyl)-2-(2-methoxy-4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 31964022
N'-(furan-2-ylmethyl)-N,N'-dimethyl-1-(4-methylphenyl)propane-1,3-diamine
CID 62617370
2-(benzotriazol-1-yl)-N-(furan-2-ylmethyl)-N-(4-methylphenyl)acetamide
CID 51189023
N-(furan-2-ylmethyl)-N-(4-methylphenyl)cyclohex-3-ene-1-carboxamide
CID 75853603

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide?
The IUPAC name of 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide (CID 43040064) is 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide.
What is the SMILES notation for 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide?
The canonical SMILES for 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide is CC(=O)NC(CC(=O)N(Cc1ccco1)c1ccc(C)cc1)c1ccc(C)cc1.
What is the InChIKey of 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide?
The InChIKey is SKIOEYGLOITXRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-17-6-10-20(11-7-17)23(25-19(3)27)15-24(28)26(16-22-5-4-14-29-22)21-12-8-18(2)9-13-21/h4-14,23H,15-16H2,1-3H3,(H,25,27).
What are the key properties of 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide?
3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide has a molecular weight of 390.48 g/mol, XLogP of 4.70, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide is sourced from PubChem (CID 43040064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).