2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine

C14H19N5 — CID 58230690

IUPAC2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine
SMILESCNc1cccc(CCNc2cccc(NC)n2)n1
InChIInChI=1S/C14H19N5/c1-15-12-6-3-5-11(18-12)9-10-17-14-8-4-7-13(16-2)19-14/h3-8H,9-10H2,1-2H3,(H,15,18)(H2,16,17,19)
InChIKeySHXCXBGJSLOBPC-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.21
Rot. Bonds6

About 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine

2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine (PubChem CID 58230690) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine
PubChem CID58230690
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC Name2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine
SMILESCNc1cccc(CCNc2cccc(NC)n2)n1
InChIInChI=1S/C14H19N5/c1-15-12-6-3-5-11(18-12)9-10-17-14-8-4-7-13(16-2)19-14/h3-8H,9-10H2,1-2H3,(H,15,18)(H2,16,17,19)
InChIKeySHXCXBGJSLOBPC-UHFFFAOYSA-N
XLogP2.21
TPSA61.87 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine?
The IUPAC name of 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine (CID 58230690) is 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine.
What is the SMILES notation for 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine?
The canonical SMILES for 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine is CNc1cccc(CCNc2cccc(NC)n2)n1.
What is the InChIKey of 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine?
The InChIKey is SHXCXBGJSLOBPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-15-12-6-3-5-11(18-12)9-10-17-14-8-4-7-13(16-2)19-14/h3-8H,9-10H2,1-2H3,(H,15,18)(H2,16,17,19).
What are the key properties of 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine?
2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine has a molecular weight of 257.34 g/mol, XLogP of 2.21, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine is sourced from PubChem (CID 58230690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).