4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine

C14H25N3 — CID 113367600

IUPAC4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine
SMILESCCC(CC)CN(CC)c1ccnc(NC)c1
InChIInChI=1S/C14H25N3/c1-5-12(6-2)11-17(7-3)13-8-9-16-14(10-13)15-4/h8-10,12H,5-7,11H2,1-4H3,(H,15,16)
InChIKeyJFPKGTZYGIQFLJ-UHFFFAOYSA-N
MW235.38 g/mol
LogP3.39
Rot. Bonds7

About 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine

4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine (PubChem CID 113367600) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine.

Molecular Properties

Compound Name4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine
PubChem CID113367600
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine
SMILESCCC(CC)CN(CC)c1ccnc(NC)c1
InChIInChI=1S/C14H25N3/c1-5-12(6-2)11-17(7-3)13-8-9-16-14(10-13)15-4/h8-10,12H,5-7,11H2,1-4H3,(H,15,16)
InChIKeyJFPKGTZYGIQFLJ-UHFFFAOYSA-N
XLogP3.39
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-ethyl-2-N-methyl-4-N-(pyridin-4-ylmethyl)pyridine-2,4-diamine
CID 113367608
2-[(tert-butylamino)methyl]-N-ethyl-N-(2-ethylbutyl)pyridin-4-amine
CID 63488590
2-[2,2-difluoroethyl-[2-(methylamino)-4-pyridinyl]amino]ethanol
CID 107495109
4-N-ethyl-4-N-(2-methylbutyl)-2-N-propylpyridine-2,4-diamine
CID 113367946
2-[(cyclopropylamino)methyl]-N-ethyl-N-(2-ethylbutyl)pyridin-4-amine
CID 62293189
2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine
CID 113367660
N,N-bis(2-ethoxyethyl)-2-hydrazinylpyridin-4-amine
CID 113368280
2-chloro-N-ethyl-N-(2-ethylbutyl)pyrimidin-4-amine
CID 62342460
4-[[bis(2-methylpropyl)amino]methyl]-N-methylpyridin-2-amine
CID 55075749
N-ethyl-N-methyl-2-(methylamino)pyridine-4-carboxamide
CID 62170484
4-N-ethyl-4-N-(2-ethylbutyl)-2-N-propylpyrimidine-2,4-diamine
CID 80799138
5-[ethyl(2-ethylbutyl)amino]pyridine-2-carboxylic acid
CID 115490832

Frequently Asked Questions

What is the IUPAC name of 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine?
The IUPAC name of 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine (CID 113367600) is 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine.
What is the SMILES notation for 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine?
The canonical SMILES for 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine is CCC(CC)CN(CC)c1ccnc(NC)c1.
What is the InChIKey of 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine?
The InChIKey is JFPKGTZYGIQFLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-5-12(6-2)11-17(7-3)13-8-9-16-14(10-13)15-4/h8-10,12H,5-7,11H2,1-4H3,(H,15,16).
What are the key properties of 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine?
4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine has a molecular weight of 235.38 g/mol, XLogP of 3.39, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine is sourced from PubChem (CID 113367600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).