2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine

C10H21N3 — CID 18520352

IUPAC2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine
SMILESCC/C=N/CCNCC/N=C/CC
InChIInChI=1S/C10H21N3/c1-3-5-11-7-9-13-10-8-12-6-4-2/h5-6,13H,3-4,7-10H2,1-2H3/b11-5+,12-6+
InChIKeyIMAHJPLSGGMJRA-YDWXAUTNSA-N
MW183.30 g/mol
LogP1.54
Rot. Bonds8

About 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine

2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine (PubChem CID 18520352) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine.

Molecular Properties

Compound Name2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine
PubChem CID18520352
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine
SMILESCC/C=N/CCNCC/N=C/CC
InChIInChI=1S/C10H21N3/c1-3-5-11-7-9-13-10-8-12-6-4-2/h5-6,13H,3-4,7-10H2,1-2H3/b11-5+,12-6+
InChIKeyIMAHJPLSGGMJRA-YDWXAUTNSA-N
XLogP1.54
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
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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Related Compounds

1-(1-methylpropylidene)-N2-(2-((1-methylpropylidene)amino)ethyl)-
CID 18520348
1,2-Ethanediamine, N1-(2-aminoethyl)-N2-(1-methylpropylidene)-
CID 58308986
1,4,7,10-Tetrazacyclododeca-1-ene
CID 22995386
2,3,6,7-Tetrahydro-1,4-diazepine
CID 22238059
1,4,8,11-Tetraazacyclotetradecene
CID 22957943
1,4,8,11-Tetraazacyclotetradeca-4,11-diene
CID 59682507
1,5,9-Triazacyclododec-9-ene
CID 69276932
(8e,10e)-1,4,8,11-Tetraazacyclotetradeca-8,10-diene
CID 90713799
3,7-Diazanon-3-en
CID 129888059
1,4,8,11-Tetraazacyclotetradeca-4,14-diene
CID 71676813
Diamino-3,7-diaza-nona-3-ene
CID 129762244
Methyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene
CID 129818087

Frequently Asked Questions

What is the IUPAC name of 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine?
The IUPAC name of 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine (CID 18520352) is 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine.
What is the SMILES notation for 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine?
The canonical SMILES for 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine is CC/C=N/CCNCC/N=C/CC.
What is the InChIKey of 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine?
The InChIKey is IMAHJPLSGGMJRA-YDWXAUTNSA-N. The full InChI is InChI=1S/C10H21N3/c1-3-5-11-7-9-13-10-8-12-6-4-2/h5-6,13H,3-4,7-10H2,1-2H3/b11-5+,12-6+.
What are the key properties of 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine?
2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine has a molecular weight of 183.30 g/mol, XLogP of 1.54, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine is sourced from PubChem (CID 18520352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).