2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine

C14H25N3O — CID 43295635

IUPAC2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine
SMILESCCCOc1nc(N(C)CC(C)CC)ccc1N
InChIInChI=1S/C14H25N3O/c1-5-9-18-14-12(15)7-8-13(16-14)17(4)10-11(3)6-2/h7-8,11H,5-6,9-10,15H2,1-4H3
InChIKeyJRRZCZQLFGOFSD-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.93
Rot. Bonds7

About 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine

2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine (PubChem CID 43295635) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine
PubChem CID43295635
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine
SMILESCCCOc1nc(N(C)CC(C)CC)ccc1N
InChIInChI=1S/C14H25N3O/c1-5-9-18-14-12(15)7-8-13(16-14)17(4)10-11(3)6-2/h7-8,11H,5-6,9-10,15H2,1-4H3
InChIKeyJRRZCZQLFGOFSD-UHFFFAOYSA-N
XLogP2.93
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-[2-(dimethylamino)ethyl]-2-N-methyl-6-propoxypyridine-2,5-diamine
CID 63694450
2-N-methyl-2-N-(2-phenylethyl)-6-propoxypyridine-2,5-diamine
CID 65482936
2-N-benzyl-2-N-methyl-6-propoxypyridine-2,5-diamine
CID 43260749
2-N-methyl-6-propoxy-2-N-(2-pyridin-2-ylethyl)pyridine-2,5-diamine
CID 43260799
3-[(5-amino-6-propoxy-2-pyridinyl)-ethylamino]-2-methylpropanenitrile
CID 54988134
1-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]-3-methoxypropan-2-ol
CID 54993621
2-N-ethyl-2-N-phenyl-6-propoxypyridine-2,5-diamine
CID 43260685
2-N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-propoxypyridine-2,5-diamine
CID 61476370
4-[(5-amino-6-propoxy-2-pyridinyl)-methylamino]benzonitrile
CID 62981083
2-N-propan-2-yl-6-propoxypyridine-2,5-diamine
CID 43260874
2-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-N-methyl-6-propoxypyridine-2,5-diamine
CID 79303922
6-(2-propan-2-yloxyethoxy)-2-propoxypyridin-3-amine
CID 43262302

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine?
The IUPAC name of 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine (CID 43295635) is 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine.
What is the SMILES notation for 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine?
The canonical SMILES for 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine is CCCOc1nc(N(C)CC(C)CC)ccc1N.
What is the InChIKey of 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine?
The InChIKey is JRRZCZQLFGOFSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-5-9-18-14-12(15)7-8-13(16-14)17(4)10-11(3)6-2/h7-8,11H,5-6,9-10,15H2,1-4H3.
What are the key properties of 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine?
2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine has a molecular weight of 251.37 g/mol, XLogP of 2.93, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-2-N-(2-methylbutyl)-6-propoxypyridine-2,5-diamine is sourced from PubChem (CID 43295635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).