2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine

C7H25N9 — CID 123396803

IUPAC2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine
SMILESCN(N)CCN(NNCCN)NNCCN
InChIInChI=1S/C7H25N9/c1-15(10)6-7-16(13-11-4-2-8)14-12-5-3-9/h11-14H,2-10H2,1H3
InChIKeyVAAAGIJCMKMTDX-UHFFFAOYSA-N
MW235.34 g/mol
LogP-3.97
Rot. Bonds11

About 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine

2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine (PubChem CID 123396803) has the molecular formula C7H25N9 and a molecular weight of 235.34 g/mol. Its IUPAC name is 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine.

Molecular Properties

Compound Name2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine
PubChem CID123396803
Molecular FormulaC7H25N9
Molecular Weight235.34 g/mol
Exact Mass235.22
IUPAC Name2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine
SMILESCN(N)CCN(NNCCN)NNCCN
InChIInChI=1S/C7H25N9/c1-15(10)6-7-16(13-11-4-2-8)14-12-5-3-9/h11-14H,2-10H2,1H3
InChIKeyVAAAGIJCMKMTDX-UHFFFAOYSA-N
XLogP-3.97
TPSA132.66 Ų
H-Bond Donors7
H-Bond Acceptors9
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500235.34
LogP ≤ 5-3.97
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine with MolForge

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Related Compounds

N-[2-[amino(methyl)amino]ethyl-(methylamino)amino]hydroxylamine
CID 163974814
N',N'-bis(propan-2-ylamino)ethane-1,2-diamine
CID 154306769
2-(2-aminohydrazinyl)ethanamine;hydrate
CID 87109227
N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N'-(2-aminoethyl)ethane-1,2-diamine;bis(N',N'-dimethylpropane-1,3-diamine);ethane-1,2-diamine
CID 157170431
3-[amino(methyl)amino]propanoic acid;ethane
CID 144503936
N,N-dimethylmethanamine;2-[2-(3-fluorophenyl)hydrazinyl]ethanamine
CID 174466029
2-[2-(2-aminoethyl)hydrazinyl]ethanol
CID 87694422
ethyl N-(2-aminoethylamino)carbamate
CID 134311496
N'-[2-[2-[methyl(propyl)amino]ethylamino]ethyl]ethane-1,2-diamine
CID 154558458
azane;N'-propylethane-1,2-diamine
CID 87476258
3-[amino(2-aminoethyl)amino]-3-[(2-aminoethylamino)methyl]pentane-1,5-diamine
CID 161076734
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N,N,N',N'-tetraethylethane-1,2-diamine
CID 87350577

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine?
The IUPAC name of 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine (CID 123396803) is 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine.
What is the SMILES notation for 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine?
The canonical SMILES for 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine is CN(N)CCN(NNCCN)NNCCN.
What is the InChIKey of 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine?
The InChIKey is VAAAGIJCMKMTDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H25N9/c1-15(10)6-7-16(13-11-4-2-8)14-12-5-3-9/h11-14H,2-10H2,1H3.
What are the key properties of 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine?
2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine has a molecular weight of 235.34 g/mol, XLogP of -3.97, 11 rotatable bonds, 7 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[2-(2-aminoethyl)hydrazinyl]-[2-[amino(methyl)amino]ethyl]amino]hydrazinyl]ethanamine is sourced from PubChem (CID 123396803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).