5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine

C13H22ClN3 — CID 62890418

IUPAC5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine
SMILESCCNc1ccc(Cl)c(CN(CC)C(C)C)n1
InChIInChI=1S/C13H22ClN3/c1-5-15-13-8-7-11(14)12(16-13)9-17(6-2)10(3)4/h7-8,10H,5-6,9H2,1-4H3,(H,15,16)
InChIKeyFDUYXMVMFNSNNE-UHFFFAOYSA-N
MW255.79 g/mol
LogP3.40
Rot. Bonds6

About 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine

5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine (PubChem CID 62890418) has the molecular formula C13H22ClN3 and a molecular weight of 255.79 g/mol. Its IUPAC name is 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine
PubChem CID62890418
Molecular FormulaC13H22ClN3
Molecular Weight255.79 g/mol
Exact Mass255.15
IUPAC Name5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine
SMILESCCNc1ccc(Cl)c(CN(CC)C(C)C)n1
InChIInChI=1S/C13H22ClN3/c1-5-15-13-8-7-11(14)12(16-13)9-17(6-2)10(3)4/h7-8,10H,5-6,9H2,1-4H3,(H,15,16)
InChIKeyFDUYXMVMFNSNNE-UHFFFAOYSA-N
XLogP3.40
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.79
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-ethylpropan-2-amine
CID 62892231
5-chloro-N-ethyl-6-[[methyl(3-methylbutan-2-yl)amino]methyl]pyridin-2-amine
CID 55127729
5-chloro-6-[(dipropylamino)methyl]-N-ethylpyridin-2-amine
CID 62891121
5-chloro-6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-ethylpyridin-2-amine
CID 62892052
3-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl-propan-2-ylamino]propan-1-ol
CID 62890826
2-[[3-chloro-6-(ethylamino)-2-pyridinyl]methyl-propylamino]ethanol
CID 62891160
N'-[[3-chloro-6-(ethylamino)-2-pyridinyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 62890809
5-chloro-6-[[(3-chlorophenyl)methyl-methylamino]methyl]-N-ethylpyridin-2-amine
CID 62890794
5-chloro-N-ethyl-6-[(N,3,5-trimethylanilino)methyl]pyridin-2-amine
CID 63501225
3-chloro-6-(ethylamino)-N-propan-2-yl-N-propylpyridine-2-carboxamide
CID 62169311
5-chloro-N-ethyl-6-[2-(2-methylpropoxy)ethoxymethyl]pyridin-2-amine
CID 106449250
5-chloro-6-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N-ethylpyridin-2-amine
CID 62890967

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine?
The IUPAC name of 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine (CID 62890418) is 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine is CCNc1ccc(Cl)c(CN(CC)C(C)C)n1.
What is the InChIKey of 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine?
The InChIKey is FDUYXMVMFNSNNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22ClN3/c1-5-15-13-8-7-11(14)12(16-13)9-17(6-2)10(3)4/h7-8,10H,5-6,9H2,1-4H3,(H,15,16).
What are the key properties of 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine?
5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine has a molecular weight of 255.79 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine is sourced from PubChem (CID 62890418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).