N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine

C12H21N3 — CID 142358550

IUPACN'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine
SMILESCc1ccc(N(C)CCN(C)C)c(C)n1
InChIInChI=1S/C12H21N3/c1-10-6-7-12(11(2)13-10)15(5)9-8-14(3)4/h6-7H,8-9H2,1-5H3
InChIKeyDLAOJFQTKQGRPS-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.70
Rot. Bonds4

About N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine

N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine (PubChem CID 142358550) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine
PubChem CID142358550
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC NameN'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine
SMILESCc1ccc(N(C)CCN(C)C)c(C)n1
InChIInChI=1S/C12H21N3/c1-10-6-7-12(11(2)13-10)15(5)9-8-14(3)4/h6-7H,8-9H2,1-5H3
InChIKeyDLAOJFQTKQGRPS-UHFFFAOYSA-N
XLogP1.70
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine?
The IUPAC name of N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine (CID 142358550) is N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine.
What is the SMILES notation for N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine?
The canonical SMILES for N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine is Cc1ccc(N(C)CCN(C)C)c(C)n1.
What is the InChIKey of N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine?
The InChIKey is DLAOJFQTKQGRPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-10-6-7-12(11(2)13-10)15(5)9-8-14(3)4/h6-7H,8-9H2,1-5H3.
What are the key properties of N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine?
N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine has a molecular weight of 207.32 g/mol, XLogP of 1.70, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine is sourced from PubChem (CID 142358550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).