6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine

C19H32N4O — CID 143341126

IUPAC6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
SMILESCCCN(CCC)c1cc(N)nc(OCCN=C2CCCCC2)c1
InChIInChI=1S/C19H32N4O/c1-3-11-23(12-4-2)17-14-18(20)22-19(15-17)24-13-10-21-16-8-6-5-7-9-16/h14-15H,3-13H2,1-2H3,(H2,20,22)
InChIKeyXQMOAQCHYSCLMH-UHFFFAOYSA-N
MW332.49 g/mol
LogP4.07
Rot. Bonds9

About 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine

6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine (PubChem CID 143341126) has the molecular formula C19H32N4O and a molecular weight of 332.49 g/mol. Its IUPAC name is 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine.

Molecular Properties

Compound Name6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
PubChem CID143341126
Molecular FormulaC19H32N4O
Molecular Weight332.49 g/mol
Exact Mass332.26
IUPAC Name6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
SMILESCCCN(CCC)c1cc(N)nc(OCCN=C2CCCCC2)c1
InChIInChI=1S/C19H32N4O/c1-3-11-23(12-4-2)17-14-18(20)22-19(15-17)24-13-10-21-16-8-6-5-7-9-16/h14-15H,3-13H2,1-2H3,(H2,20,22)
InChIKeyXQMOAQCHYSCLMH-UHFFFAOYSA-N
XLogP4.07
TPSA63.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

6-ethoxy-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143340794
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
ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143846971
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
6-[2-(3,4-dimethoxyphenyl)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143450233
4-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]-N-cyclohexylbutanamide
CID 143340832
ethane;6-[2-[(5-propoxy-2-pyridinyl)oxy]ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143341509
ethane;molecular hydrogen;6-(2-morpholin-4-ylethoxy)-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143340801
4-N-butyl-6-[3-[2-(methylamino)ethoxy]propoxy]-4-N-propylpyridine-2,4-diamine
CID 143533273
1-[2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl]-3-cyano-2-propylguanidine
CID 143341610

Frequently Asked Questions

What is the IUPAC name of 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine?
The IUPAC name of 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine (CID 143341126) is 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine.
What is the SMILES notation for 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine?
The canonical SMILES for 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine is CCCN(CCC)c1cc(N)nc(OCCN=C2CCCCC2)c1.
What is the InChIKey of 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine?
The InChIKey is XQMOAQCHYSCLMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N4O/c1-3-11-23(12-4-2)17-14-18(20)22-19(15-17)24-13-10-21-16-8-6-5-7-9-16/h14-15H,3-13H2,1-2H3,(H2,20,22).
What are the key properties of 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine?
6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine has a molecular weight of 332.49 g/mol, XLogP of 4.07, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(cyclohexylideneamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine is sourced from PubChem (CID 143341126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).