6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine

C15H25N3 — CID 80790042

IUPAC6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine
SMILESCCNc1cccc(N(C)C2CCCCCC2)n1
InChIInChI=1S/C15H25N3/c1-3-16-14-11-8-12-15(17-14)18(2)13-9-6-4-5-7-10-13/h8,11-13H,3-7,9-10H2,1-2H3,(H,16,17)
InChIKeyMYGPBNDKZLBMFI-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.67
Rot. Bonds4

About 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine

6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine (PubChem CID 80790042) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine
PubChem CID80790042
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine
SMILESCCNc1cccc(N(C)C2CCCCCC2)n1
InChIInChI=1S/C15H25N3/c1-3-16-14-11-8-12-15(17-14)18(2)13-9-6-4-5-7-10-13/h8,11-13H,3-7,9-10H2,1-2H3,(H,16,17)
InChIKeyMYGPBNDKZLBMFI-UHFFFAOYSA-N
XLogP3.67
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-cycloheptyl-6-N-methyl-2-N-propylpyridine-2,6-diamine
CID 80789572
2-N-ethyl-6-N-(1-ethylpiperidin-4-yl)-6-N-methylpyridine-2,6-diamine
CID 80820475
2-N-cyclopentyl-6-N-ethyl-2-N-methylpyrazine-2,6-diamine
CID 80773857
N-cyclohexyl-N,6-dimethylpyridin-2-amine
CID 133313190
6-[[cyclohexyl(ethyl)amino]methyl]-N-ethylpyridin-2-amine
CID 79243595
2-N-ethyl-6-N-methyl-6-N-phenylpyridine-2,6-diamine
CID 80767103
N-cyclobutyl-N,6-dimethylpyridin-2-amine
CID 130668195
N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine
CID 62278994
1-[[6-(ethylamino)-2-pyridinyl]-methylamino]propan-2-ol
CID 80827221
6-N-(3,3-dimethylbutan-2-yl)-2-N-ethyl-6-N-methylpyridine-2,6-diamine
CID 80814827
N-cyclohexyl-N-ethyl-6-hydrazinylpyridin-2-amine
CID 80928374
2-N,6-N-dimethyl-6-N-(3-methylcyclohexyl)pyridine-2,6-diamine
CID 80799265

Frequently Asked Questions

What is the IUPAC name of 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine?
The IUPAC name of 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine (CID 80790042) is 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine?
The canonical SMILES for 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine is CCNc1cccc(N(C)C2CCCCCC2)n1.
What is the InChIKey of 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine?
The InChIKey is MYGPBNDKZLBMFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-16-14-11-8-12-15(17-14)18(2)13-9-6-4-5-7-10-13/h8,11-13H,3-7,9-10H2,1-2H3,(H,16,17).
What are the key properties of 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine?
6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine has a molecular weight of 247.39 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-cycloheptyl-2-N-ethyl-6-N-methylpyridine-2,6-diamine is sourced from PubChem (CID 80790042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).