2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine

C13H23N3O — CID 43270938

IUPAC2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine
SMILESCCCN(C)c1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C13H23N3O/c1-6-9-16(5)11-8-7-10(14)12(15-11)17-13(2,3)4/h7-8H,6,9,14H2,1-5H3
InChIKeySNTXVTGRYGLROG-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.69
Rot. Bonds4

About 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine

2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine (PubChem CID 43270938) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine
PubChem CID43270938
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine
SMILESCCCN(C)c1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C13H23N3O/c1-6-9-16(5)11-8-7-10(14)12(15-11)17-13(2,3)4/h7-8H,6,9,14H2,1-5H3
InChIKeySNTXVTGRYGLROG-UHFFFAOYSA-N
XLogP2.69
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine?
The IUPAC name of 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine (CID 43270938) is 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine?
The canonical SMILES for 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine is CCCN(C)c1ccc(N)c(OC(C)(C)C)n1.
What is the InChIKey of 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine?
The InChIKey is SNTXVTGRYGLROG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-6-9-16(5)11-8-7-10(14)12(15-11)17-13(2,3)4/h7-8H,6,9,14H2,1-5H3.
What are the key properties of 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine?
2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine has a molecular weight of 237.35 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine is sourced from PubChem (CID 43270938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).