6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine

C15H25N3O — CID 43571839

IUPAC6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine
SMILESCCCC(C)N(C)c1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C15H25N3O/c1-4-5-11(2)18(3)14-9-8-13(16)15(17-14)19-10-12-6-7-12/h8-9,11-12H,4-7,10,16H2,1-3H3
InChIKeyNVVIAOZJEUGLFD-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.08
Rot. Bonds7

About 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine

6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine (PubChem CID 43571839) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine.

Molecular Properties

Compound Name6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine
PubChem CID43571839
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine
SMILESCCCC(C)N(C)c1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C15H25N3O/c1-4-5-11(2)18(3)14-9-8-13(16)15(17-14)19-10-12-6-7-12/h8-9,11-12H,4-7,10,16H2,1-3H3
InChIKeyNVVIAOZJEUGLFD-UHFFFAOYSA-N
XLogP3.08
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine?
The IUPAC name of 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine (CID 43571839) is 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine.
What is the SMILES notation for 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine?
The canonical SMILES for 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine is CCCC(C)N(C)c1ccc(N)c(OCC2CC2)n1.
What is the InChIKey of 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine?
The InChIKey is NVVIAOZJEUGLFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-5-11(2)18(3)14-9-8-13(16)15(17-14)19-10-12-6-7-12/h8-9,11-12H,4-7,10,16H2,1-3H3.
What are the key properties of 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine?
6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine has a molecular weight of 263.38 g/mol, XLogP of 3.08, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethoxy)-2-N-methyl-2-N-pentan-2-ylpyridine-2,5-diamine is sourced from PubChem (CID 43571839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).