6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine

C11H10Cl2N2S — CID 63586888

IUPAC6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine
SMILESCN(Cc1ccc(Cl)s1)c1cccc(Cl)n1
InChIInChI=1S/C11H10Cl2N2S/c1-15(7-8-5-6-10(13)16-8)11-4-2-3-9(12)14-11/h2-6H,7H2,1H3
InChIKeyCHPHSALZCHTMRK-UHFFFAOYSA-N
MW273.19 g/mol
LogP4.09
Rot. Bonds3

About 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine

6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine (PubChem CID 63586888) has the molecular formula C11H10Cl2N2S and a molecular weight of 273.19 g/mol. Its IUPAC name is 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine
PubChem CID63586888
Molecular FormulaC11H10Cl2N2S
Molecular Weight273.19 g/mol
Exact Mass271.99
IUPAC Name6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine
SMILESCN(Cc1ccc(Cl)s1)c1cccc(Cl)n1
InChIInChI=1S/C11H10Cl2N2S/c1-15(7-8-5-6-10(13)16-8)11-4-2-3-9(12)14-11/h2-6H,7H2,1H3
InChIKeyCHPHSALZCHTMRK-UHFFFAOYSA-N
XLogP4.09
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.19
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-6-(propylaminomethyl)pyridin-2-amine
CID 62282523
6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102715602
3-chloro-6-[(5-chlorothiophen-2-yl)methyl-methylamino]pyridine-2-carboxylic acid
CID 61439995
[2-[(5-chlorothiophen-2-yl)methyl-methylamino]quinolin-4-yl]methanol
CID 61442554
2-N-[(5-chlorothiophen-2-yl)methyl]-2-N-methyl-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 63402501
N-[(5-chlorothiophen-2-yl)methyl]-6-(ethylaminomethyl)-N-methylpyridazin-3-amine
CID 62281503
2-N-[(5-chlorothiophen-2-yl)methyl]-6-N-ethyl-2-N-methylpyrazine-2,6-diamine
CID 78918157
6-[(5-chlorothiophen-2-yl)methyl-methylamino]pyridine-3-carbothioamide
CID 61442067
4-(chloromethyl)-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine
CID 61442160
4-(aminomethyl)-N-[(5-chlorothiophen-2-yl)methyl]-N-methylaniline
CID 61438708
N-[(5-chlorothiophen-2-yl)methyl]-5-fluoro-N-methylquinazolin-4-amine
CID 55853674
4-N-[(5-chlorothiophen-2-yl)methyl]-4-N-methyl-6-N-propylpyrimidine-2,4,6-triamine
CID 80799386

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine (CID 63586888) is 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine is CN(Cc1ccc(Cl)s1)c1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine?
The InChIKey is CHPHSALZCHTMRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2S/c1-15(7-8-5-6-10(13)16-8)11-4-2-3-9(12)14-11/h2-6H,7H2,1H3.
What are the key properties of 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine?
6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine has a molecular weight of 273.19 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 63586888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).