2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine

C10H18N2 — CID 69333646

IUPAC2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine
SMILESCC1=CC(N)=C(C)C(C)C1(C)N
InChIInChI=1S/C10H18N2/c1-6-5-9(11)7(2)8(3)10(6,4)12/h5,8H,11-12H2,1-4H3
InChIKeyXTFSHUFLNZNTBL-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.53
Rot. Bonds

About 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine

2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine (PubChem CID 69333646) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine.

Molecular Properties

Compound Name2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine
PubChem CID69333646
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine
SMILESCC1=CC(N)=C(C)C(C)C1(C)N
InChIInChI=1S/C10H18N2/c1-6-5-9(11)7(2)8(3)10(6,4)12/h5,8H,11-12H2,1-4H3
InChIKeyXTFSHUFLNZNTBL-UHFFFAOYSA-N
XLogP1.53
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine?
The IUPAC name of 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine (CID 69333646) is 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine.
What is the SMILES notation for 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine?
The canonical SMILES for 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine is CC1=CC(N)=C(C)C(C)C1(C)N.
What is the InChIKey of 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine?
The InChIKey is XTFSHUFLNZNTBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-6-5-9(11)7(2)8(3)10(6,4)12/h5,8H,11-12H2,1-4H3.
What are the key properties of 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine?
2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine has a molecular weight of 166.27 g/mol, XLogP of 1.53, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethylcyclohexa-1,5-diene-1,4-diamine is sourced from PubChem (CID 69333646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).