1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine

C11H23N3 — CID 73165533

IUPAC1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine
SMILESCN(C)C=CC=CC(N(C)C)N(C)C
InChIInChI=1S/C11H23N3/c1-12(2)10-8-7-9-11(13(3)4)14(5)6/h7-11H,1-6H3
InChIKeyPYLGDVVZCFDRAN-UHFFFAOYSA-N
MW197.33 g/mol
LogP1.07
Rot. Bonds5

About 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine

1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine (PubChem CID 73165533) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine.

Molecular Properties

Compound Name1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine
PubChem CID73165533
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine
SMILESCN(C)C=CC=CC(N(C)C)N(C)C
InChIInChI=1S/C11H23N3/c1-12(2)10-8-7-9-11(13(3)4)14(5)6/h7-11H,1-6H3
InChIKeyPYLGDVVZCFDRAN-UHFFFAOYSA-N
XLogP1.07
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine with MolForge

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Related Compounds

1-N,1-N,1-N',1-N'-tetramethylbuta-1,3-diene-1,1-diamine
CID 14992949
4-Bis(dimethylamino)but-2-ene
CID 22151997
Pylgdvvzcfdran-fiflttcusa-
CID 13081047
(E)-1-N,1-N,1-N',1-N',3-N,3-N-hexamethylprop-2-ene-1,1,3-triamine
CID 12662339
1,1'-Methylenebis-pyridine
CID 22976701
(1Z)-1-N,1-N-diethyl-4-methyl-1-N',1-N'-bis(prop-2-enyl)penta-1,3-diene-1,1-diamine
CID 134923782
CID 139242688
CID 139242688
CID 139242689
CID 139242689
N-ethyl-N-(2H-pyridin-1-ylmethyl)ethanamine
CID 20646151
1-N,1-N,1-N',1-N'-tetramethylbut-2-ene-1,1-diamine
CID 53715921
N,N,1-trimethyl-2H-pyridin-6-amine
CID 54297992
1-methyl-N,N-dipropyl-2H-pyridin-6-amine
CID 56612432

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine?
The IUPAC name of 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine (CID 73165533) is 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine.
What is the SMILES notation for 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine?
The canonical SMILES for 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine is CN(C)C=CC=CC(N(C)C)N(C)C.
What is the InChIKey of 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine?
The InChIKey is PYLGDVVZCFDRAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-12(2)10-8-7-9-11(13(3)4)14(5)6/h7-11H,1-6H3.
What are the key properties of 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine?
1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine has a molecular weight of 197.33 g/mol, XLogP of 1.07, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,1-N',1-N',5-N,5-N-hexamethylpenta-2,4-diene-1,1,5-triamine is sourced from PubChem (CID 73165533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).