5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine

C14H15Cl2N3 — CID 104532123

IUPAC5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine
SMILESCCCNc1cncc(Nc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C14H15Cl2N3/c1-2-5-18-11-7-12(9-17-8-11)19-14-4-3-10(15)6-13(14)16/h3-4,6-9,18-19H,2,5H2,1H3
InChIKeyZPMUUZAMLUIPOD-UHFFFAOYSA-N
MW296.20 g/mol
LogP4.95
Rot. Bonds5

About 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine

5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine (PubChem CID 104532123) has the molecular formula C14H15Cl2N3 and a molecular weight of 296.20 g/mol. Its IUPAC name is 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine
PubChem CID104532123
Molecular FormulaC14H15Cl2N3
Molecular Weight296.20 g/mol
Exact Mass295.06
IUPAC Name5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine
SMILESCCCNc1cncc(Nc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C14H15Cl2N3/c1-2-5-18-11-7-12(9-17-8-11)19-14-4-3-10(15)6-13(14)16/h3-4,6-9,18-19H,2,5H2,1H3
InChIKeyZPMUUZAMLUIPOD-UHFFFAOYSA-N
XLogP4.95
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.20
LogP ≤ 54.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-(5-chloro-2-methylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104532088
3-N-propyl-5-N-(2,3,4-trifluorophenyl)pyridine-3,5-diamine
CID 104532161
5-N-(5-chloro-2-methoxyphenyl)-3-N-propylpyridine-3,5-diamine
CID 104532269
5-(2,4-dichloroanilino)-N-propylpyridine-3-carboxamide
CID 109222941
5-N-(3-chloro-2-fluorophenyl)-3-N-propylpyridine-3,5-diamine
CID 104532112
5-N-(2-fluoro-5-methylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104532100
5-N-(4-fluoro-2-iodophenyl)-3-N-propylpyridine-3,5-diamine
CID 104535267
5-N-[(3-chloro-4-fluorophenyl)methyl]-3-N-propylpyridine-3,5-diamine
CID 104534286
5-N-(3,5-dimethylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104532378
5-N-(5-bromo-2-methylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104533102
5-chloro-4-N-(2,4-dichlorophenyl)-2-N-propylpyrimidine-2,4-diamine
CID 80759449
5-N-(2-methoxy-5-methylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104532272

Frequently Asked Questions

What is the IUPAC name of 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine?
The IUPAC name of 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine (CID 104532123) is 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine.
What is the SMILES notation for 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine?
The canonical SMILES for 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine is CCCNc1cncc(Nc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine?
The InChIKey is ZPMUUZAMLUIPOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2N3/c1-2-5-18-11-7-12(9-17-8-11)19-14-4-3-10(15)6-13(14)16/h3-4,6-9,18-19H,2,5H2,1H3.
What are the key properties of 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine?
5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine has a molecular weight of 296.20 g/mol, XLogP of 4.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2,4-dichlorophenyl)-3-N-propylpyridine-3,5-diamine is sourced from PubChem (CID 104532123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).