N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine

C10H27N5 — CID 157466747

IUPACN'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine
SMILESCCN(CCN)CCN(CCN)CCN
InChIInChI=1S/C10H27N5/c1-2-14(6-3-11)9-10-15(7-4-12)8-5-13/h2-13H2,1H3
InChIKeyBUOKVUDVFZIOEH-UHFFFAOYSA-N
MW217.36 g/mol
LogP-1.51
Rot. Bonds10

About N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine

N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine (PubChem CID 157466747) has the molecular formula C10H27N5 and a molecular weight of 217.36 g/mol. Its IUPAC name is N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine
PubChem CID157466747
Molecular FormulaC10H27N5
Molecular Weight217.36 g/mol
Exact Mass217.23
IUPAC NameN'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine
SMILESCCN(CCN)CCN(CCN)CCN
InChIInChI=1S/C10H27N5/c1-2-14(6-3-11)9-10-15(7-4-12)8-5-13/h2-13H2,1H3
InChIKeyBUOKVUDVFZIOEH-UHFFFAOYSA-N
XLogP-1.51
TPSA84.54 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 5-1.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N'-(2-aminoethyl)-N'-[2-(diethylamino)ethyl]ethane-1,2-diamine
CID 107912667
N'-[2-(dimethylamino)ethyl]-N'-ethylethane-1,2-diamine;ethane
CID 143734586
N'-(2-aminoethyl)-N'-ethylpropane-1,3-diamine
CID 55289486
2-[2-aminoethyl(ethyl)amino]ethanethiol
CID 145098138
CID 172703845
CID 172703845
N'-(3-aminopropyl)-N'-[3-[3-[bis(3-aminopropyl)amino]propyl-[3-[3-[bis[3-[bis(3-aminopropyl)amino]propyl]amino]propyl-[3-[3-[bis[3-[bis[3-[bis(3-aminopropyl)amino]propyl]amino]propyl]amino]propyl-ethylamino]propyl]amino]propyl]amino]propyl]propane-1,3-diamine
CID 59097400
N-ethyl-N,N',N'-tripropylethane-1,2-diamine
CID 88655813
N',N'-bis(2-aminoethyl)ethane-1,2-diamine;ethane;N-methylmethanamine
CID 163255552
acetic acid;N',N'-diethylethane-1,2-diamine
CID 175226296
N'-(3-aminopropyl)-N'-ethylbutane-1,4-diamine
CID 86127606
3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide
CID 61351237
N'-(2-butoxyethyl)-N'-ethylethane-1,2-diamine
CID 61483279

Frequently Asked Questions

What is the IUPAC name of N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine?
The IUPAC name of N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine (CID 157466747) is N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine.
What is the SMILES notation for N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine?
The canonical SMILES for N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine is CCN(CCN)CCN(CCN)CCN.
What is the InChIKey of N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine?
The InChIKey is BUOKVUDVFZIOEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H27N5/c1-2-14(6-3-11)9-10-15(7-4-12)8-5-13/h2-13H2,1H3.
What are the key properties of N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine?
N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine has a molecular weight of 217.36 g/mol, XLogP of -1.51, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine is sourced from PubChem (CID 157466747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).