1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine

C10H26N4 — CID 123998123

IUPAC1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine
SMILESCCN(CC)CCNC(CN)N(C)C
InChIInChI=1S/C10H26N4/c1-5-14(6-2)8-7-12-10(9-11)13(3)4/h10,12H,5-9,11H2,1-4H3
InChIKeyQTWHRMJZPMJHKX-UHFFFAOYSA-N
MW202.35 g/mol
LogP-0.24
Rot. Bonds8

About 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine

1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine (PubChem CID 123998123) has the molecular formula C10H26N4 and a molecular weight of 202.35 g/mol. Its IUPAC name is 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine.

Molecular Properties

Compound Name1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine
PubChem CID123998123
Molecular FormulaC10H26N4
Molecular Weight202.35 g/mol
Exact Mass202.22
IUPAC Name1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine
SMILESCCN(CC)CCNC(CN)N(C)C
InChIInChI=1S/C10H26N4/c1-5-14(6-2)8-7-12-10(9-11)13(3)4/h10,12H,5-9,11H2,1-4H3
InChIKeyQTWHRMJZPMJHKX-UHFFFAOYSA-N
XLogP-0.24
TPSA44.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.35
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-N-[3-[2-(diethylamino)ethylamino]-3-(dimethylamino)propyl]-1-N',1-N'-diethylpropane-1,1,3-triamine
CID 57157918
2-N-[2-(diethylamino)ethyl]-3-methylbutane-1,2-diamine
CID 65385472
2-N-[2-(diethylamino)ethyl]-3-ethylpentane-1,2-diamine
CID 65382937
1-cyclopropyl-N-[2-(diethylamino)ethyl]ethane-1,2-diamine
CID 65385048
2-N,4-N-bis[2-(diethylamino)ethyl]pentane-2,4-diamine
CID 5239027
N',N'-diethyl-N-methylethane-1,2-diamine;ethane
CID 142004273
N,N-diethyl-2-hydrazinylethanamine
CID 3028735
4-amino-3-[2-(diethylamino)ethylamino]-N-propan-2-ylbutanamide
CID 66430169
N'-[2-(diethylamino)ethyl]-2-propan-2-ylpropane-1,3-diamine
CID 107441031
4-N-[2-(diethylamino)ethyl]-1-N,1-N-diethylpentane-1,4-diamine
CID 43199211
N-[2-(diethylamino)ethyl]-1-(thiolan-3-yl)ethane-1,2-diamine
CID 107132785
N-[2-(diethylamino)ethyl]-1-(3,5-dimethoxyphenyl)ethane-1,2-diamine
CID 65383358

Frequently Asked Questions

What is the IUPAC name of 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine?
The IUPAC name of 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine (CID 123998123) is 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine.
What is the SMILES notation for 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine?
The canonical SMILES for 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine is CCN(CC)CCNC(CN)N(C)C.
What is the InChIKey of 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine?
The InChIKey is QTWHRMJZPMJHKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H26N4/c1-5-14(6-2)8-7-12-10(9-11)13(3)4/h10,12H,5-9,11H2,1-4H3.
What are the key properties of 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine?
1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine has a molecular weight of 202.35 g/mol, XLogP of -0.24, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-[2-(diethylamino)ethyl]-1-N',1-N'-dimethylethane-1,1,2-triamine is sourced from PubChem (CID 123998123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).