2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine

C14H25N3O — CID 113367660

IUPAC2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine
SMILESCCNc1cc(N(CCOC)CC(C)C)ccn1
InChIInChI=1S/C14H25N3O/c1-5-15-14-10-13(6-7-16-14)17(8-9-18-4)11-12(2)3/h6-7,10,12H,5,8-9,11H2,1-4H3,(H,15,16)
InChIKeySOFKOWRSOSKNIE-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.62
Rot. Bonds8

About 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine

2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine (PubChem CID 113367660) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine.

Molecular Properties

Compound Name2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine
PubChem CID113367660
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine
SMILESCCNc1cc(N(CCOC)CC(C)C)ccn1
InChIInChI=1S/C14H25N3O/c1-5-15-14-10-13(6-7-16-14)17(8-9-18-4)11-12(2)3/h6-7,10,12H,5,8-9,11H2,1-4H3,(H,15,16)
InChIKeySOFKOWRSOSKNIE-UHFFFAOYSA-N
XLogP2.62
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridin-4-amine
CID 62285332
4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridin-2-amine
CID 55059734
6-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)-2-methylsulfanylpyrimidine-4,6-diamine
CID 80804755
4-N-(2-methoxyethyl)-2-methyl-4-N-(2-methylpropyl)benzene-1,4-diamine
CID 54987138
4-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
CID 62469766
2-[[2-(ethylamino)-4-pyridinyl]-methylamino]propan-1-ol
CID 104557112
4-N-cyclopropyl-4-N-(2-methoxyethyl)-2-N-propylpyridine-2,4-diamine
CID 113367615
(1S)-1-[5-[2-methoxyethyl(2-methylpropyl)amino]-2-pyridinyl]propan-1-ol
CID 103938533
4-N-ethyl-4-N-(2-ethylbutyl)-2-N-methylpyridine-2,4-diamine
CID 113367600
2-(ethylaminomethyl)-N,N-bis(2-methylpropyl)pyridin-4-amine
CID 62284205
2-(ethylamino)-3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 105385257
4-(1-aminoethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)aniline
CID 54987087

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine?
The IUPAC name of 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine (CID 113367660) is 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine.
What is the SMILES notation for 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine?
The canonical SMILES for 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine is CCNc1cc(N(CCOC)CC(C)C)ccn1.
What is the InChIKey of 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine?
The InChIKey is SOFKOWRSOSKNIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-5-15-14-10-13(6-7-16-14)17(8-9-18-4)11-12(2)3/h6-7,10,12H,5,8-9,11H2,1-4H3,(H,15,16).
What are the key properties of 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine?
2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine has a molecular weight of 251.37 g/mol, XLogP of 2.62, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)pyridine-2,4-diamine is sourced from PubChem (CID 113367660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).