1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide

C24H40N2O2 — CID 21020517

IUPAC1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide
SMILESCCCN(CCC)C(=O)C1=C(C(=O)N(CCC)CCC)C2(C)C(C)=C(C)C12C
InChIInChI=1S/C24H40N2O2/c1-9-13-25(14-10-2)21(27)19-20(22(28)26(15-11-3)16-12-4)24(8)18(6)17(5)23(19,24)7/h9-16H2,1-8H3
InChIKeyIAKGZWWCHWNQOJ-UHFFFAOYSA-N
MW388.60 g/mol
LogP4.96
Rot. Bonds10

About 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide

1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide (PubChem CID 21020517) has the molecular formula C24H40N2O2 and a molecular weight of 388.60 g/mol. Its IUPAC name is 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide.

Molecular Properties

Compound Name1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide
PubChem CID21020517
Molecular FormulaC24H40N2O2
Molecular Weight388.60 g/mol
Exact Mass388.31
IUPAC Name1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide
SMILESCCCN(CCC)C(=O)C1=C(C(=O)N(CCC)CCC)C2(C)C(C)=C(C)C12C
InChIInChI=1S/C24H40N2O2/c1-9-13-25(14-10-2)21(27)19-20(22(28)26(15-11-3)16-12-4)24(8)18(6)17(5)23(19,24)7/h9-16H2,1-8H3
InChIKeyIAKGZWWCHWNQOJ-UHFFFAOYSA-N
XLogP4.96
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.60
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide?
The IUPAC name of 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide (CID 21020517) is 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide.
What is the SMILES notation for 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide?
The canonical SMILES for 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide is CCCN(CCC)C(=O)C1=C(C(=O)N(CCC)CCC)C2(C)C(C)=C(C)C12C.
What is the InChIKey of 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide?
The InChIKey is IAKGZWWCHWNQOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H40N2O2/c1-9-13-25(14-10-2)21(27)19-20(22(28)26(15-11-3)16-12-4)24(8)18(6)17(5)23(19,24)7/h9-16H2,1-8H3.
What are the key properties of 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide?
1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide has a molecular weight of 388.60 g/mol, XLogP of 4.96, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,5,6-tetramethyl-2-N,2-N,3-N,3-N-tetrapropylbicyclo[2.2.0]hexa-2,5-diene-2,3-dicarboxamide is sourced from PubChem (CID 21020517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).