5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine

C13H19N3 — CID 104533509

IUPAC5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine
SMILESCNc1cncc(NC(C2CC2)C2CC2)c1
InChIInChI=1S/C13H19N3/c1-14-11-6-12(8-15-7-11)16-13(9-2-3-9)10-4-5-10/h6-10,13-14,16H,2-5H2,1H3
InChIKeyDYBWHXMNQWVMIS-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.72
Rot. Bonds5

About 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine

5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine (PubChem CID 104533509) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine
PubChem CID104533509
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine
SMILESCNc1cncc(NC(C2CC2)C2CC2)c1
InChIInChI=1S/C13H19N3/c1-14-11-6-12(8-15-7-11)16-13(9-2-3-9)10-4-5-10/h6-10,13-14,16H,2-5H2,1H3
InChIKeyDYBWHXMNQWVMIS-UHFFFAOYSA-N
XLogP2.72
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-[1-(dimethylamino)propan-2-yl]-3-N-methylpyridine-3,5-diamine
CID 104535616
5-N-(1-cyclopropylethyl)-3-N-propylpyridine-3,5-diamine
CID 104532953
5-N-(1-ethoxypropan-2-yl)-3-N-methylpyridine-3,5-diamine
CID 104533936
3-N-methyl-5-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3,5-diamine
CID 104535034
3-N-methyl-5-N-(2-methylcycloheptyl)pyridine-3,5-diamine
CID 104535085
3-N-methyl-5-N-(1-methylsulfonylpropan-2-yl)pyridine-3,5-diamine
CID 104534914
N-(dicyclopropylmethyl)-3,5-dimethoxyaniline
CID 43173321
5-N-(1-methoxypentan-2-yl)-3-N-methylpyridine-3,5-diamine
CID 104534857
3-N-methyl-5-N-(2-propan-2-yloxyethyl)pyridine-3,5-diamine
CID 104767059
N-(dicyclopropylmethyl)-6-methylsulfanylpyridin-3-amine
CID 115929475
N-(dicyclopropylmethyl)-3-fluoro-5-methylaniline
CID 79054393
N-ethyl-2-[[5-(methylamino)-3-pyridinyl]amino]propanamide
CID 104533495

Frequently Asked Questions

What is the IUPAC name of 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine?
The IUPAC name of 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine (CID 104533509) is 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine.
What is the SMILES notation for 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine?
The canonical SMILES for 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine is CNc1cncc(NC(C2CC2)C2CC2)c1.
What is the InChIKey of 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine?
The InChIKey is DYBWHXMNQWVMIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-14-11-6-12(8-15-7-11)16-13(9-2-3-9)10-4-5-10/h6-10,13-14,16H,2-5H2,1H3.
What are the key properties of 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine?
5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine has a molecular weight of 217.32 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(dicyclopropylmethyl)-3-N-methylpyridine-3,5-diamine is sourced from PubChem (CID 104533509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).