ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine

C18H35N3O3 — CID 143846971

IUPACethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
SMILESCC.CCCN(CCC)c1cc(N)nc(OCCOCCOC)c1
InChIInChI=1S/C16H29N3O3.C2H6/c1-4-6-19(7-5-2)14-12-15(17)18-16(13-14)22-11-10-21-9-8-20-3;1-2/h12-13H,4-11H2,1-3H3,(H2,17,18);1-2H3
InChIKeyZERKIJCXOJPADP-UHFFFAOYSA-N
MW341.50 g/mol
LogP3.36
Rot. Bonds12

About ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine

ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine (PubChem CID 143846971) has the molecular formula C18H35N3O3 and a molecular weight of 341.50 g/mol. Its IUPAC name is ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine.

Molecular Properties

Compound Nameethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
PubChem CID143846971
Molecular FormulaC18H35N3O3
Molecular Weight341.50 g/mol
Exact Mass341.27
IUPAC Nameethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
SMILESCC.CCCN(CCC)c1cc(N)nc(OCCOCCOC)c1
InChIInChI=1S/C16H29N3O3.C2H6/c1-4-6-19(7-5-2)14-12-15(17)18-16(13-14)22-11-10-21-9-8-20-3;1-2/h12-13H,4-11H2,1-3H3,(H2,17,18);1-2H3
InChIKeyZERKIJCXOJPADP-UHFFFAOYSA-N
XLogP3.36
TPSA69.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.50
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-ethoxy-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143340794
4-N,4-N-dipropyl-6-(2-pyridin-2-yloxyethoxy)pyridine-2,4-diamine;ethane
CID 143341149
ethane;6-[2-(2-methyl-1H-imidazol-5-yl)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143450300
ethane;6-[2-[(5-propoxy-2-pyridinyl)oxy]ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143341509
4-N-butyl-6-[3-[2-(methylamino)ethoxy]propoxy]-4-N-propylpyridine-2,4-diamine
CID 143533273
6-[2-(3,4-dimethoxyphenyl)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143450233
6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143341126
6-[2-(cyclohexylamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine;ethane
CID 143846965
1-[2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl]pyrrolidine-2,5-dione
CID 143341116
2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate
CID 143341161
2-[5-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]pent-1-en-2-ylamino]ethanol;ethane;propane
CID 143847042
6-N,6-N-dimethyl-4-N,4-N-dipropylpyridine-2,4,6-triamine;ethane
CID 143533485

Frequently Asked Questions

What is the IUPAC name of ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine?
The IUPAC name of ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine (CID 143846971) is ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine.
What is the SMILES notation for ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine?
The canonical SMILES for ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine is CC.CCCN(CCC)c1cc(N)nc(OCCOCCOC)c1.
What is the InChIKey of ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine?
The InChIKey is ZERKIJCXOJPADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O3.C2H6/c1-4-6-19(7-5-2)14-12-15(17)18-16(13-14)22-11-10-21-9-8-20-3;1-2/h12-13H,4-11H2,1-3H3,(H2,17,18);1-2H3.
What are the key properties of ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine?
ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine has a molecular weight of 341.50 g/mol, XLogP of 3.36, 12 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine is sourced from PubChem (CID 143846971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).