2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine

C10H21N3 — CID 15477845

IUPAC2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine
SMILESCC(C)=NCCNCCN=C(C)C
InChIInChI=1S/C10H21N3/c1-9(2)12-7-5-11-6-8-13-10(3)4/h11H,5-8H2,1-4H3
InChIKeyFPHDXPRLWRPJNS-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.54
Rot. Bonds6

About 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine

2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine (PubChem CID 15477845) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine.

Molecular Properties

Compound Name2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine
PubChem CID15477845
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine
SMILESCC(C)=NCCNCCN=C(C)C
InChIInChI=1S/C10H21N3/c1-9(2)12-7-5-11-6-8-13-10(3)4/h11H,5-8H2,1-4H3
InChIKeyFPHDXPRLWRPJNS-UHFFFAOYSA-N
XLogP1.54
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine?
The IUPAC name of 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine (CID 15477845) is 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine.
What is the SMILES notation for 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine?
The canonical SMILES for 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine is CC(C)=NCCNCCN=C(C)C.
What is the InChIKey of 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine?
The InChIKey is FPHDXPRLWRPJNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-9(2)12-7-5-11-6-8-13-10(3)4/h11H,5-8H2,1-4H3.
What are the key properties of 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine?
2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine has a molecular weight of 183.30 g/mol, XLogP of 1.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propan-2-ylideneamino)-N-[2-(propan-2-ylideneamino)ethyl]ethanamine is sourced from PubChem (CID 15477845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).