1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide

C24H40N2O2 — CID 3616296

IUPAC1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide
SMILESCC(C)CN(CC(C)C)C(=O)c1ccc(C(=O)N(CC(C)C)CC(C)C)cc1
InChIInChI=1S/C24H40N2O2/c1-17(2)13-25(14-18(3)4)23(27)21-9-11-22(12-10-21)24(28)26(15-19(5)6)16-20(7)8/h9-12,17-20H,13-16H2,1-8H3
InChIKeyATXRKEAFJHQTPD-UHFFFAOYSA-N
MW388.60 g/mol
LogP5.20
Rot. Bonds10

About 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide

1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide (PubChem CID 3616296) has the molecular formula C24H40N2O2 and a molecular weight of 388.60 g/mol. Its IUPAC name is 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide
PubChem CID3616296
Molecular FormulaC24H40N2O2
Molecular Weight388.60 g/mol
Exact Mass388.31
IUPAC Name1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide
SMILESCC(C)CN(CC(C)C)C(=O)c1ccc(C(=O)N(CC(C)C)CC(C)C)cc1
InChIInChI=1S/C24H40N2O2/c1-17(2)13-25(14-18(3)4)23(27)21-9-11-22(12-10-21)24(28)26(15-19(5)6)16-20(7)8/h9-12,17-20H,13-16H2,1-8H3
InChIKeyATXRKEAFJHQTPD-UHFFFAOYSA-N
XLogP5.20
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.60
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-N,N-bis(2-methylpropyl)benzamide
CID 17386163
4-carbamothioyl-N,N-bis(2-methylpropyl)benzamide
CID 61378658
4-[ethyl(2-methylpropyl)carbamoyl]benzoic acid
CID 43452953
4-amino-N-ethyl-N-(2-methylpropyl)benzamide;hydrochloride
CID 119732301
4-amino-3-fluoro-N,N-bis(2-methylpropyl)benzamide
CID 62680023
3-bromo-4-chloro-N,N-bis(2-methylpropyl)benzamide
CID 107999335
N,N-bis(2-methylpropyl)-1,3-benzodioxole-5-carboxamide
CID 4668559
methyl 4-[2-methoxyethyl(2-methylpropyl)carbamoyl]benzoate
CID 134059038
4-amino-N,N-bis(3-methylbutyl)benzamide;hydrochloride
CID 119672598
4-amino-3,5-difluoro-N,N-bis(2-methylpropyl)benzamide
CID 63185021
N-ethyl-N-(2-methylpropyl)-2,3-dihydro-1H-isoindole-5-carboxamide
CID 113363545
N-(2-cyanoethyl)-4-(dimethylamino)-N-(2-methylpropyl)benzamide
CID 60654474

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide?
The IUPAC name of 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide (CID 3616296) is 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide?
The canonical SMILES for 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide is CC(C)CN(CC(C)C)C(=O)c1ccc(C(=O)N(CC(C)C)CC(C)C)cc1.
What is the InChIKey of 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide?
The InChIKey is ATXRKEAFJHQTPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H40N2O2/c1-17(2)13-25(14-18(3)4)23(27)21-9-11-22(12-10-21)24(28)26(15-19(5)6)16-20(7)8/h9-12,17-20H,13-16H2,1-8H3.
What are the key properties of 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide?
1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide has a molecular weight of 388.60 g/mol, XLogP of 5.20, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 3616296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).