2-(ethylamino)propylidene-propan-2-ylideneazanium

C8H17N2+ — CID 123490263

IUPAC2-(ethylamino)propylidene-propan-2-ylideneazanium
SMILESCCNC(C)C=[N+]=C(C)C
InChIInChI=1S/C8H17N2/c1-5-9-8(4)6-10-7(2)3/h6,8-9H,5H2,1-4H3/q+1
InChIKeyZURXXHZZYFFDOP-UHFFFAOYSA-N
MW141.24 g/mol
LogP0.60
Rot. Bonds3

About 2-(ethylamino)propylidene-propan-2-ylideneazanium

2-(ethylamino)propylidene-propan-2-ylideneazanium (PubChem CID 123490263) has the molecular formula C8H17N2+ and a molecular weight of 141.24 g/mol. Its IUPAC name is 2-(ethylamino)propylidene-propan-2-ylideneazanium.

Molecular Properties

Compound Name2-(ethylamino)propylidene-propan-2-ylideneazanium
PubChem CID123490263
Molecular FormulaC8H17N2+
Molecular Weight141.24 g/mol
Exact Mass141.14
IUPAC Name2-(ethylamino)propylidene-propan-2-ylideneazanium
SMILESCCNC(C)C=[N+]=C(C)C
InChIInChI=1S/C8H17N2/c1-5-9-8(4)6-10-7(2)3/h6,8-9H,5H2,1-4H3/q+1
InChIKeyZURXXHZZYFFDOP-UHFFFAOYSA-N
XLogP0.60
TPSA26.13 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Analyze 2-(ethylamino)propylidene-propan-2-ylideneazanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-methylpropylidene)-N2-(2-((1-methylpropylidene)amino)ethyl)-
CID 18520348
1,2-Ethanediamine, N1-(2-aminoethyl)-N2-(1-methylpropylidene)-
CID 58308986
N-(2-tert-butyliminoethyl)-2-methylpropan-2-amine
CID 11361786
3,7-Diazanon-3-en
CID 129888059
2-Butylamino-3-butyliminobutane
CID 13794591
5,7-Dimethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene
CID 129657984
(2R)-3,3-dimethyl-N-propan-2-yl-1-propan-2-yliminobutan-2-amine
CID 76763881
2-methyl-N-propan-2-yl-1-propan-2-yliminopropan-2-amine
CID 15741736
N-ethylethanamine;N-ethylethanimine
CID 17938054
2-(propylideneamino)-N-[2-(propylideneamino)ethyl]ethanamine
CID 18520352
N'-[2-(butylideneamino)ethyl]ethane-1,2-diamine
CID 57324714
(2S)-N-methyl-1-methyliminobutan-2-amine
CID 59124503

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)propylidene-propan-2-ylideneazanium?
The IUPAC name of 2-(ethylamino)propylidene-propan-2-ylideneazanium (CID 123490263) is 2-(ethylamino)propylidene-propan-2-ylideneazanium.
What is the SMILES notation for 2-(ethylamino)propylidene-propan-2-ylideneazanium?
The canonical SMILES for 2-(ethylamino)propylidene-propan-2-ylideneazanium is CCNC(C)C=[N+]=C(C)C.
What is the InChIKey of 2-(ethylamino)propylidene-propan-2-ylideneazanium?
The InChIKey is ZURXXHZZYFFDOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N2/c1-5-9-8(4)6-10-7(2)3/h6,8-9H,5H2,1-4H3/q+1.
What are the key properties of 2-(ethylamino)propylidene-propan-2-ylideneazanium?
2-(ethylamino)propylidene-propan-2-ylideneazanium has a molecular weight of 141.24 g/mol, XLogP of 0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)propylidene-propan-2-ylideneazanium is sourced from PubChem (CID 123490263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).