2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine

C12H19N3 — CID 80838786

IUPAC2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine
SMILESCNc1cccc(N(C)CC2CC2C)n1
InChIInChI=1S/C12H19N3/c1-9-7-10(9)8-15(3)12-6-4-5-11(13-2)14-12/h4-6,9-10H,7-8H2,1-3H3,(H,13,14)
InChIKeyFSCOTVXYKOHGJJ-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.22
Rot. Bonds4

About 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine

2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine (PubChem CID 80838786) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine
PubChem CID80838786
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine
SMILESCNc1cccc(N(C)CC2CC2C)n1
InChIInChI=1S/C12H19N3/c1-9-7-10(9)8-15(3)12-6-4-5-11(13-2)14-12/h4-6,9-10H,7-8H2,1-3H3,(H,13,14)
InChIKeyFSCOTVXYKOHGJJ-UHFFFAOYSA-N
XLogP2.22
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine?
The IUPAC name of 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine (CID 80838786) is 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine.
What is the SMILES notation for 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine?
The canonical SMILES for 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine is CNc1cccc(N(C)CC2CC2C)n1.
What is the InChIKey of 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine?
The InChIKey is FSCOTVXYKOHGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-9-7-10(9)8-15(3)12-6-4-5-11(13-2)14-12/h4-6,9-10H,7-8H2,1-3H3,(H,13,14).
What are the key properties of 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine?
2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine has a molecular weight of 205.31 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-dimethyl-6-N-[(2-methylcyclopropyl)methyl]pyridine-2,6-diamine is sourced from PubChem (CID 80838786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).