5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine

C15H24ClN3 — CID 104968876

IUPAC5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine
SMILESCCNc1ccc(Cl)c(CN2[C@H](C)CCC[C@@H]2C)n1
InChIInChI=1S/C15H24ClN3/c1-4-17-15-9-8-13(16)14(18-15)10-19-11(2)6-5-7-12(19)3/h8-9,11-12H,4-7,10H2,1-3H3,(H,17,18)/t11-,12+
InChIKeyLHHZFKHVXYROCV-TXEJJXNPSA-N
MW281.83 g/mol
LogP3.93
Rot. Bonds4

About 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine

5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine (PubChem CID 104968876) has the molecular formula C15H24ClN3 and a molecular weight of 281.83 g/mol. Its IUPAC name is 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine
PubChem CID104968876
Molecular FormulaC15H24ClN3
Molecular Weight281.83 g/mol
Exact Mass281.17
IUPAC Name5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine
SMILESCCNc1ccc(Cl)c(CN2[C@H](C)CCC[C@@H]2C)n1
InChIInChI=1S/C15H24ClN3/c1-4-17-15-9-8-13(16)14(18-15)10-19-11(2)6-5-7-12(19)3/h8-9,11-12H,4-7,10H2,1-3H3,(H,17,18)/t11-,12+
InChIKeyLHHZFKHVXYROCV-TXEJJXNPSA-N
XLogP3.93
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.83
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-ethyl-6-[(2-methylpyrrolidin-1-yl)methyl]pyridin-2-amine
CID 62890748
5-chloro-N-ethyl-6-[(2-ethylpiperidin-1-yl)methyl]pyridin-2-amine
CID 62891478
1-[[3-chloro-6-(ethylamino)-2-pyridinyl]methyl]piperidine-2,6-dione
CID 55127786
[5-chloro-6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-2-pyridinyl]hydrazine
CID 83221611
5-chloro-6-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]-N-ethylpyridin-2-amine
CID 63165745
[1-[[3-chloro-6-(ethylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol
CID 62891805
5-chloro-6-(cyclohexylsulfanylmethyl)-N-ethylpyridin-2-amine
CID 63487271
5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine
CID 62886168
5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-ethylpyrazin-2-amine
CID 103055473
5-chloro-N-ethyl-6-[(1-oxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine
CID 55127587
5-chloro-6-[(4-chloropyrazol-1-yl)methyl]-N-ethylpyridin-2-amine
CID 62886659
5-chloro-6-[(3,5-dimethylpyrazol-1-yl)methyl]-N-ethylpyridin-2-amine
CID 62891537

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine?
The IUPAC name of 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine (CID 104968876) is 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine?
The canonical SMILES for 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine is CCNc1ccc(Cl)c(CN2[C@H](C)CCC[C@@H]2C)n1.
What is the InChIKey of 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine?
The InChIKey is LHHZFKHVXYROCV-TXEJJXNPSA-N. The full InChI is InChI=1S/C15H24ClN3/c1-4-17-15-9-8-13(16)14(18-15)10-19-11(2)6-5-7-12(19)3/h8-9,11-12H,4-7,10H2,1-3H3,(H,17,18)/t11-,12+.
What are the key properties of 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine?
5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine has a molecular weight of 281.83 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 104968876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).