1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine

C10H23N3 — CID 71333716

IUPAC1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine
SMILESCC(=CN(C)C)C(N(C)C)N(C)C
InChIInChI=1S/C10H23N3/c1-9(8-11(2)3)10(12(4)5)13(6)7/h8,10H,1-7H3
InChIKeyMWQKCUNURPNJOW-UHFFFAOYSA-N
MW185.31 g/mol
LogP0.90
Rot. Bonds4

About 1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine

1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine (PubChem CID 71333716) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine.

Molecular Properties

Compound Name1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine
PubChem CID71333716
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC Name1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine
SMILESCC(=CN(C)C)C(N(C)C)N(C)C
InChIInChI=1S/C10H23N3/c1-9(8-11(2)3)10(12(4)5)13(6)7/h8,10H,1-7H3
InChIKeyMWQKCUNURPNJOW-UHFFFAOYSA-N
XLogP0.90
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine?
The IUPAC name of 1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine (CID 71333716) is 1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine.
What is the SMILES notation for 1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine?
The canonical SMILES for 1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine is CC(=CN(C)C)C(N(C)C)N(C)C.
What is the InChIKey of 1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine?
The InChIKey is MWQKCUNURPNJOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3/c1-9(8-11(2)3)10(12(4)5)13(6)7/h8,10H,1-7H3.
What are the key properties of 1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine?
1-N,1-N,1-N',1-N',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine has a molecular weight of 185.31 g/mol, XLogP of 0.90, 4 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',3-N,3-N,2-heptamethylprop-2-ene-1,1,3-triamine is sourced from PubChem (CID 71333716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).