5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine

C15H24ClN3O — CID 82743738

IUPAC5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(Cl)c(CN(C)C2CCOC2C)n1
InChIInChI=1S/C15H24ClN3O/c1-4-8-17-15-6-5-12(16)13(18-15)10-19(3)14-7-9-20-11(14)2/h5-6,11,14H,4,7-10H2,1-3H3,(H,17,18)
InChIKeyWZNICLMEOQQAKL-UHFFFAOYSA-N
MW297.83 g/mol
LogP3.17
Rot. Bonds6

About 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine

5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine (PubChem CID 82743738) has the molecular formula C15H24ClN3O and a molecular weight of 297.83 g/mol. Its IUPAC name is 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine
PubChem CID82743738
Molecular FormulaC15H24ClN3O
Molecular Weight297.83 g/mol
Exact Mass297.16
IUPAC Name5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(Cl)c(CN(C)C2CCOC2C)n1
InChIInChI=1S/C15H24ClN3O/c1-4-8-17-15-6-5-12(16)13(18-15)10-19(3)14-7-9-20-11(14)2/h5-6,11,14H,4,7-10H2,1-3H3,(H,17,18)
InChIKeyWZNICLMEOQQAKL-UHFFFAOYSA-N
XLogP3.17
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.83
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3,6-dichloro-2-pyridinyl)methyl]-N,2-dimethyloxolan-3-amine
CID 82734079
5-chloro-6-[[cyclopropyl(methyl)amino]methyl]-N-propylpyridin-2-amine
CID 62891819
5-chloro-6-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine
CID 62890773
5-chloro-6-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]-N-propylpyridin-2-amine
CID 79309758
5-chloro-6-[(4-methylpiperidin-1-yl)methyl]-N-propylpyridin-2-amine
CID 62892502
5-chloro-6-[[methyl(2-methylsulfanylethyl)amino]methyl]-N-propylpyridin-2-amine
CID 112664254
5-chloro-6-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
CID 62891483
2-[[3-chloro-6-(propylamino)-2-pyridinyl]methyl-methylamino]-N,N-dimethylacetamide
CID 62890423
6-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-ylmethyl)-5-chloro-N-propylpyridin-2-amine
CID 62890974
5-chloro-6-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine
CID 62891652
3-[[3-chloro-6-(propylamino)-2-pyridinyl]methyl-ethylamino]propanenitrile
CID 62890808
2-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyridin-3-amine
CID 104740240

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine?
The IUPAC name of 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine (CID 82743738) is 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine is CCCNc1ccc(Cl)c(CN(C)C2CCOC2C)n1.
What is the InChIKey of 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine?
The InChIKey is WZNICLMEOQQAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24ClN3O/c1-4-8-17-15-6-5-12(16)13(18-15)10-19(3)14-7-9-20-11(14)2/h5-6,11,14H,4,7-10H2,1-3H3,(H,17,18).
What are the key properties of 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine?
5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine has a molecular weight of 297.83 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 82743738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).