N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine

C61H148N20 — CID 160549747

IUPACN'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine
SMILESCN(C)CCN(CCCN(CCN(C)C)CCN(C)C)CCN(C)C.CN(C)CCN(CCN(C)C)CCN(C)C.CN(C)CCN(CCN(C)C)CCN(CCN(CCN(C)C)CCN(C)C)CCN(CCN(C)C)CCN(C)C
InChIInChI=1S/C30H72N10.C19H46N6.C12H30N4/c1-31(2)13-19-37(20-14-32(3)4)25-28-40(29-26-38(21-15-33(5)6)22-16-34(7)8)30-27-39(23-17-35(9)10)24-18-36(11)12;1-20(2)12-16-24(17-13-21(3)4)10-9-11-25(18-14-22(5)6)19-15-23(7)8;1-13(2)7-10-16(11-8-14(3)4)12-9-15(5)6/h13-30H2,1-12H3;9-19H2,1-8H3;7-12H2,1-6H3
InChIKeyQXXBXHVJZDOVIL-UHFFFAOYSA-N
MW1161.99 g/mol
LogP-0.24
Rot. Bonds52

About N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine

N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine (PubChem CID 160549747) has the molecular formula C61H148N20 and a molecular weight of 1161.99 g/mol. Its IUPAC name is N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine.

Molecular Properties

Compound NameN'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine
PubChem CID160549747
Molecular FormulaC61H148N20
Molecular Weight1161.99 g/mol
Exact Mass1161.22
IUPAC NameN'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine
SMILESCN(C)CCN(CCCN(CCN(C)C)CCN(C)C)CCN(C)C.CN(C)CCN(CCN(C)C)CCN(C)C.CN(C)CCN(CCN(C)C)CCN(CCN(CCN(C)C)CCN(C)C)CCN(CCN(C)C)CCN(C)C
InChIInChI=1S/C30H72N10.C19H46N6.C12H30N4/c1-31(2)13-19-37(20-14-32(3)4)25-28-40(29-26-38(21-15-33(5)6)22-16-34(7)8)30-27-39(23-17-35(9)10)24-18-36(11)12;1-20(2)12-16-24(17-13-21(3)4)10-9-11-25(18-14-22(5)6)19-15-23(7)8;1-13(2)7-10-16(11-8-14(3)4)12-9-15(5)6/h13-30H2,1-12H3;9-19H2,1-8H3;7-12H2,1-6H3
InChIKeyQXXBXHVJZDOVIL-UHFFFAOYSA-N
XLogP-0.24
TPSA64.80 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds52
Heavy Atoms81
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001161.99
LogP ≤ 5-0.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine with MolForge

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Related Compounds

N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N'-[2-[2-(dimethylamino)ethyl-methylamino]ethyl]-N,N,N'-trimethylethane-1,2-diamine;N'-[2-(dimethylamino)ethyl]-N,N,N'-trimethylethane-1,2-diamine;N,N,N',N'-tetramethylethane-1,2-diamine
CID 163585742
N,N-dimethyl-N',N'-dipropylpropane-1,3-diamine
CID 89150859
2-[2-(dimethylamino)ethyl-(2-hydroxyethyl)amino]ethanol
CID 22056833
N',N'-diethyl-N,N-dimethylethane-1,2-diamine;ethane
CID 143296680
N,N'-bis[2-(dimethylamino)ethyl]-N,N'-dimethylpropane-1,3-diamine
CID 547219
N'-[3-(dimethylamino)propyl]-N,N,N'-trimethylpropane-1,3-diamine;ethane
CID 171793143
CID 175787026
CID 175787026
CID 173338058
CID 173338058
CID 88826921
CID 88826921
5-[2-(dimethylamino)ethyl-propylamino]pentan-1-ol
CID 62228988
N,N-dimethyl-N'-[(E)-octadec-9-enyl]-N'-octylethane-1,2-diamine
CID 71498362
N'-[2-(dimethylamino)ethyl]-N,N'-dipropylbutane-1,4-diamine
CID 62436376

Frequently Asked Questions

What is the IUPAC name of N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine?
The IUPAC name of N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine (CID 160549747) is N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine.
What is the SMILES notation for N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine?
The canonical SMILES for N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine is CN(C)CCN(CCCN(CCN(C)C)CCN(C)C)CCN(C)C.CN(C)CCN(CCN(C)C)CCN(C)C.CN(C)CCN(CCN(C)C)CCN(CCN(CCN(C)C)CCN(C)C)CCN(CCN(C)C)CCN(C)C.
What is the InChIKey of N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine?
The InChIKey is QXXBXHVJZDOVIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H72N10.C19H46N6.C12H30N4/c1-31(2)13-19-37(20-14-32(3)4)25-28-40(29-26-38(21-15-33(5)6)22-16-34(7)8)30-27-39(23-17-35(9)10)24-18-36(11)12;1-20(2)12-16-24(17-13-21(3)4)10-9-11-25(18-14-22(5)6)19-15-23(7)8;1-13(2)7-10-16(11-8-14(3)4)12-9-15(5)6/h13-30H2,1-12H3;9-19H2,1-8H3;7-12H2,1-6H3.
What are the key properties of N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine?
N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine has a molecular weight of 1161.99 g/mol, XLogP of -0.24, 52 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-[bis[2-[bis[2-(dimethylamino)ethyl]amino]ethyl]amino]ethyl]-N'-[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N,N,N',N'-tetrakis[2-(dimethylamino)ethyl]propane-1,3-diamine is sourced from PubChem (CID 160549747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).