N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine

C15H27N3 — CID 79481119

IUPACN-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine
SMILESCCNc1ccc(CN(CC)CC(C)CC)cn1
InChIInChI=1S/C15H27N3/c1-5-13(4)11-18(7-3)12-14-8-9-15(16-6-2)17-10-14/h8-10,13H,5-7,11-12H2,1-4H3,(H,16,17)
InChIKeyKWYZMLJETOVVNN-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.38
Rot. Bonds8

About N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine

N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine (PubChem CID 79481119) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine
PubChem CID79481119
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC NameN-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine
SMILESCCNc1ccc(CN(CC)CC(C)CC)cn1
InChIInChI=1S/C15H27N3/c1-5-13(4)11-18(7-3)12-14-8-9-15(16-6-2)17-10-14/h8-10,13H,5-7,11-12H2,1-4H3,(H,16,17)
InChIKeyKWYZMLJETOVVNN-UHFFFAOYSA-N
XLogP3.38
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-[[2-methylpropyl(pentan-3-yl)amino]methyl]pyridin-2-amine
CID 79490493
N-ethyl-5-[(N-ethylanilino)methyl]pyridin-2-amine
CID 62182688
5-[[benzyl(methyl)amino]methyl]-N-ethylpyridin-2-amine
CID 55046066
2-[ethyl-[[6-(propylamino)-3-pyridinyl]methyl]amino]ethanol
CID 62182263
5-[[cyclopentyl(ethyl)amino]methyl]-N-ethylpyridin-2-amine
CID 62184162
5-[(dipropylamino)methyl]-N-propylpyridin-2-amine
CID 62183383
5-[(N,4-dimethylanilino)methyl]-N-ethylpyridin-2-amine
CID 55046130
2-[4-[[ethyl(2-methylbutyl)amino]methyl]phenyl]acetic acid
CID 105346105
5-[[cycloheptyl(methyl)amino]methyl]-N-ethylpyridin-2-amine
CID 62183656
5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
CID 62183338
N-ethyl-5-[(N-ethyl-3-methylanilino)methyl]pyridin-2-amine
CID 62182436
N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine
CID 62208787

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine?
The IUPAC name of N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine (CID 79481119) is N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine is CCNc1ccc(CN(CC)CC(C)CC)cn1.
What is the InChIKey of N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine?
The InChIKey is KWYZMLJETOVVNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-5-13(4)11-18(7-3)12-14-8-9-15(16-6-2)17-10-14/h8-10,13H,5-7,11-12H2,1-4H3,(H,16,17).
What are the key properties of N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine?
N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine has a molecular weight of 249.40 g/mol, XLogP of 3.38, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-[[ethyl(2-methylbutyl)amino]methyl]pyridin-2-amine is sourced from PubChem (CID 79481119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).