4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide

C20H24N2O2 — CID 109043167

IUPAC4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
SMILESCC(C)NC(=O)c1ccc(C(=O)Nc2ccccc2C(C)C)cc1
InChIInChI=1S/C20H24N2O2/c1-13(2)17-7-5-6-8-18(17)22-20(24)16-11-9-15(10-12-16)19(23)21-14(3)4/h5-14H,1-4H3,(H,21,23)(H,22,24)
InChIKeySMGSYVVNYIRFFR-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.20
Rot. Bonds5

About 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide

4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide (PubChem CID 109043167) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
PubChem CID109043167
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
SMILESCC(C)NC(=O)c1ccc(C(=O)Nc2ccccc2C(C)C)cc1
InChIInChI=1S/C20H24N2O2/c1-13(2)17-7-5-6-8-18(17)22-20(24)16-11-9-15(10-12-16)19(23)21-14(3)4/h5-14H,1-4H3,(H,21,23)(H,22,24)
InChIKeySMGSYVVNYIRFFR-UHFFFAOYSA-N
XLogP4.20
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-propan-2-ylphenyl)benzamide
CID 723391
4-N-(2-fluorophenyl)-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109049811
4-(methylamino)-N-(2-propan-2-ylphenyl)benzamide
CID 62185459
1-N-(4-methoxyphenyl)-4-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109049815
4-N-(2-propan-2-ylphenyl)-1-N-propylbenzene-1,4-dicarboxamide
CID 109042975
N-(2-propan-2-ylphenyl)-4-propoxybenzamide
CID 6463952
4-(methanesulfonamido)-N-(2-propan-2-ylphenyl)benzamide
CID 51179900
4-(3-methylbutoxy)-N-(2-propan-2-ylphenyl)benzamide
CID 17093762
1-N-(3-methoxypropyl)-4-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109045330
4-(methylsulfonylmethyl)-N-(2-propan-2-ylphenyl)benzamide
CID 9094036
1-N-butyl-4-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109043746
3,4,5-triethoxy-N-(2-propan-2-ylphenyl)benzamide
CID 1350696

Frequently Asked Questions

What is the IUPAC name of 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide?
The IUPAC name of 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide (CID 109043167) is 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide?
The canonical SMILES for 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide is CC(C)NC(=O)c1ccc(C(=O)Nc2ccccc2C(C)C)cc1.
What is the InChIKey of 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide?
The InChIKey is SMGSYVVNYIRFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-13(2)17-7-5-6-8-18(17)22-20(24)16-11-9-15(10-12-16)19(23)21-14(3)4/h5-14H,1-4H3,(H,21,23)(H,22,24).
What are the key properties of 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide?
4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide has a molecular weight of 324.42 g/mol, XLogP of 4.20, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 109043167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).