6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine

C17H22ClN3 — CID 79234167

IUPAC6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CN(C)Cc2ccccc2Cl)n1
InChIInChI=1S/C17H22ClN3/c1-3-11-19-17-10-6-8-15(20-17)13-21(2)12-14-7-4-5-9-16(14)18/h4-10H,3,11-13H2,1-2H3,(H,19,20)
InChIKeyBOPQSADADCNYKW-UHFFFAOYSA-N
MW303.84 g/mol
LogP4.19
Rot. Bonds7

About 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine

6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine (PubChem CID 79234167) has the molecular formula C17H22ClN3 and a molecular weight of 303.84 g/mol. Its IUPAC name is 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine
PubChem CID79234167
Molecular FormulaC17H22ClN3
Molecular Weight303.84 g/mol
Exact Mass303.15
IUPAC Name6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CN(C)Cc2ccccc2Cl)n1
InChIInChI=1S/C17H22ClN3/c1-3-11-19-17-10-6-8-15(20-17)13-21(2)12-14-7-4-5-9-16(14)18/h4-10H,3,11-13H2,1-2H3,(H,19,20)
InChIKeyBOPQSADADCNYKW-UHFFFAOYSA-N
XLogP4.19
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.84
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79243670
5-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine
CID 62207430
6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylpyridin-2-amine
CID 79243620
5-chloro-6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-ethylpyridin-2-amine
CID 62892052
6-[[methyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 79243172
1-(2-chlorophenyl)-N-[(2-chlorophenyl)methyl]-N-methylmethanamine
CID 71304139
3-[methyl-[[6-(propylamino)-2-pyridinyl]methyl]amino]propanenitrile
CID 79243775
6-[[(2-chlorophenyl)methyl-methylamino]methyl]pyridine-2-carboxylic acid
CID 106904019
6-[[(2-chlorophenyl)methyl-methylamino]methyl]pyridine-2-carbohydrazide
CID 106909258
6-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]-N-propylpyridin-2-amine
CID 79244019
6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine
CID 79243531
6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine
CID 79233870

Frequently Asked Questions

What is the IUPAC name of 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine?
The IUPAC name of 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine (CID 79234167) is 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine is CCCNc1cccc(CN(C)Cc2ccccc2Cl)n1.
What is the InChIKey of 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine?
The InChIKey is BOPQSADADCNYKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22ClN3/c1-3-11-19-17-10-6-8-15(20-17)13-21(2)12-14-7-4-5-9-16(14)18/h4-10H,3,11-13H2,1-2H3,(H,19,20).
What are the key properties of 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine?
6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine has a molecular weight of 303.84 g/mol, XLogP of 4.19, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 79234167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).