N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide

C24H29NO2 — CID 10713768

IUPACN-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide
SMILESCC1=C(C(=O)NC(C)(C)C)CC(c2ccc(C)cc2)(c2ccc(C)cc2)O1
InChIInChI=1S/C24H29NO2/c1-16-7-11-19(12-8-16)24(20-13-9-17(2)10-14-20)15-21(18(3)27-24)22(26)25-23(4,5)6/h7-14H,15H2,1-6H3,(H,25,26)
InChIKeyIXYBUZLPQYVGAV-UHFFFAOYSA-N
MW363.50 g/mol
LogP5.16
Rot. Bonds3

About N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide

N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide (PubChem CID 10713768) has the molecular formula C24H29NO2 and a molecular weight of 363.50 g/mol. Its IUPAC name is N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide
PubChem CID10713768
Molecular FormulaC24H29NO2
Molecular Weight363.50 g/mol
Exact Mass363.22
IUPAC NameN-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide
SMILESCC1=C(C(=O)NC(C)(C)C)CC(c2ccc(C)cc2)(c2ccc(C)cc2)O1
InChIInChI=1S/C24H29NO2/c1-16-7-11-19(12-8-16)24(20-13-9-17(2)10-14-20)15-21(18(3)27-24)22(26)25-23(4,5)6/h7-14H,15H2,1-6H3,(H,25,26)
InChIKeyIXYBUZLPQYVGAV-UHFFFAOYSA-N
XLogP5.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.50
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 164642017
2-(4-fluorophenyl)-N,6-dimethyl-5-phenyl-3a,4-dihydro-1-benzofuran-3-carboxamide
CID 123235562
(1R,2R,3S)-N-tert-butyl-2-methyl-2-(4-methylphenyl)-3-phenylmethoxycyclopropane-1-carboxamide
CID 139041674
N-tert-butyl-2,2-bis(4-fluorophenyl)-5-methyl-3H-furan-4-carboxamide
CID 11793579
2,2-Diphenyltetrahydrofuran-5-acetamide, N-t-butyl-
CID 593827
N-tert-butyl-2-[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]acetamide
CID 59818414
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CID 68807719
(5S)-N-tert-butyl-6-phenylmethoxy-5-[(4-phenylphenyl)methyl]hept-6-enamide
CID 142354573
N-benzyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide
CID 10642847
N-tert-butyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide
CID 10664528
N-butyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide
CID 10688221
N-(2-hydroxyethyl)-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide
CID 10711051

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide?
The IUPAC name of N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide (CID 10713768) is N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide.
What is the SMILES notation for N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide?
The canonical SMILES for N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide is CC1=C(C(=O)NC(C)(C)C)CC(c2ccc(C)cc2)(c2ccc(C)cc2)O1.
What is the InChIKey of N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide?
The InChIKey is IXYBUZLPQYVGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29NO2/c1-16-7-11-19(12-8-16)24(20-13-9-17(2)10-14-20)15-21(18(3)27-24)22(26)25-23(4,5)6/h7-14H,15H2,1-6H3,(H,25,26).
What are the key properties of N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide?
N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide has a molecular weight of 363.50 g/mol, XLogP of 5.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide is sourced from PubChem (CID 10713768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).