2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine

C14H19N3S — CID 80798911

IUPAC2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine
SMILESCCNc1cccc(N(CC)Cc2cccs2)n1
InChIInChI=1S/C14H19N3S/c1-3-15-13-8-5-9-14(16-13)17(4-2)11-12-7-6-10-18-12/h5-10H,3-4,11H2,1-2H3,(H,15,16)
InChIKeySCNCSTITQDIOEQ-UHFFFAOYSA-N
MW261.39 g/mol
LogP3.60
Rot. Bonds6

About 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine

2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine (PubChem CID 80798911) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine
PubChem CID80798911
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC Name2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine
SMILESCCNc1cccc(N(CC)Cc2cccs2)n1
InChIInChI=1S/C14H19N3S/c1-3-15-13-8-5-9-14(16-13)17(4-2)11-12-7-6-10-18-12/h5-10H,3-4,11H2,1-2H3,(H,15,16)
InChIKeySCNCSTITQDIOEQ-UHFFFAOYSA-N
XLogP3.60
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N,6-N,2-triethyl-4-N-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine
CID 80933060
2-N,4-N-diethyl-4-N-(thiophen-2-ylmethyl)pyrimidine-2,4-diamine
CID 80798994
2-N,6-N-diethyl-4-N,4-N-dimethyl-2-N-(thiophen-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine
CID 80779800
6-chloro-2-N,4-N-diethyl-2-N-(thiophen-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80799671
6-N-[3-(dimethylamino)propyl]-2-N,6-N-diethylpyridine-2,6-diamine
CID 102998802
6-(ethylamino)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 62240687
3-[ethyl-[6-(ethylamino)-2-pyridinyl]amino]propanenitrile
CID 80806487
6-ethoxy-2-N,4-N-diethyl-2-N-(thiophen-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80779648
6-chloro-N-ethyl-2-propyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 80938995
6-N,2-diethyl-4-N-methyl-4-N-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine
CID 80934269
6-N-benzyl-6-N-ethyl-2-N-propylpyridine-2,6-diamine
CID 80753536
N-ethyl-5-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine
CID 107379721

Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine?
The IUPAC name of 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine (CID 80798911) is 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine.
What is the SMILES notation for 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine?
The canonical SMILES for 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine is CCNc1cccc(N(CC)Cc2cccs2)n1.
What is the InChIKey of 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine?
The InChIKey is SCNCSTITQDIOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-3-15-13-8-5-9-14(16-13)17(4-2)11-12-7-6-10-18-12/h5-10H,3-4,11H2,1-2H3,(H,15,16).
What are the key properties of 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine?
2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine has a molecular weight of 261.39 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-diethyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine is sourced from PubChem (CID 80798911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).