1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide

C12H22N2O2 — CID 551854

IUPAC1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide
SMILESCN(C)C(=O)C1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C12H22N2O2/c1-13(2)11(15)9-5-7-10(8-6-9)12(16)14(3)4/h9-10H,5-8H2,1-4H3
InChIKeyPACFFRDVNFNFAC-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.97
Rot. Bonds2

About 1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide

1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide (PubChem CID 551854) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide
PubChem CID551854
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide
SMILESCN(C)C(=O)C1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C12H22N2O2/c1-13(2)11(15)9-5-7-10(8-6-9)12(16)14(3)4/h9-10H,5-8H2,1-4H3
InChIKeyPACFFRDVNFNFAC-UHFFFAOYSA-N
XLogP0.97
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide?
The IUPAC name of 1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide (CID 551854) is 1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide.
What is the SMILES notation for 1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide?
The canonical SMILES for 1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide is CN(C)C(=O)C1CCC(C(=O)N(C)C)CC1.
What is the InChIKey of 1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide?
The InChIKey is PACFFRDVNFNFAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-13(2)11(15)9-5-7-10(8-6-9)12(16)14(3)4/h9-10H,5-8H2,1-4H3.
What are the key properties of 1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide?
1-N,1-N,4-N,4-N-tetramethylcyclohexane-1,4-dicarboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.97, 2 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-tetramethylcyclohexane-1,4-dicarboxamide is sourced from PubChem (CID 551854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).