(2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine

C11H10Cl2N2S — CID 43559065

IUPAC(2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine
SMILESCc1cnc(C(N)c2cccc(Cl)c2Cl)s1
InChIInChI=1S/C11H10Cl2N2S/c1-6-5-15-11(16-6)10(14)7-3-2-4-8(12)9(7)13/h2-5,10H,14H2,1H3
InChIKeyPJCXUBKNGATCHV-UHFFFAOYSA-N
MW273.19 g/mol
LogP3.81
Rot. Bonds2

About (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine

(2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine (PubChem CID 43559065) has the molecular formula C11H10Cl2N2S and a molecular weight of 273.19 g/mol. Its IUPAC name is (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine.

Molecular Properties

Compound Name(2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine
PubChem CID43559065
Molecular FormulaC11H10Cl2N2S
Molecular Weight273.19 g/mol
Exact Mass271.99
IUPAC Name(2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine
SMILESCc1cnc(C(N)c2cccc(Cl)c2Cl)s1
InChIInChI=1S/C11H10Cl2N2S/c1-6-5-15-11(16-6)10(14)7-3-2-4-8(12)9(7)13/h2-5,10H,14H2,1H3
InChIKeyPJCXUBKNGATCHV-UHFFFAOYSA-N
XLogP3.81
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.19
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-methyl-1,3-thiazol-2-yl)-(4-propan-2-ylphenyl)methanamine
CID 43558963
(2,3-dichlorophenyl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine
CID 61330680
(2,3-dichlorophenyl)-(2,5-dichlorothiophen-3-yl)methanamine
CID 43344832
(5-bromo-2-fluorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine
CID 43559026
(5-bromo-2-pyridinyl)-(2,3-dichlorophenyl)methanamine
CID 113398377
(2,3-dichlorophenyl)methanediamine
CID 139660481
1-(2,3-dichlorophenyl)ethanamine chloride
CID 51371192
(2,3-dichlorophenyl)-(2,5-dimethylpyrazol-3-yl)methanamine
CID 105141854
(4-ethylphenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine
CID 43559043
(2,3-dichlorophenyl)-(3-methoxy-4-pyridinyl)methanamine
CID 105065497
(2,3-dichlorophenyl)-(2,3,4,5,6-pentafluorophenyl)methanamine
CID 115851182
(5-methyl-1,3-thiazol-2-yl)-[4-(trifluoromethyl)phenyl]methanamine
CID 43559003

Frequently Asked Questions

What is the IUPAC name of (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine?
The IUPAC name of (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine (CID 43559065) is (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine.
What is the SMILES notation for (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine?
The canonical SMILES for (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine is Cc1cnc(C(N)c2cccc(Cl)c2Cl)s1.
What is the InChIKey of (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine?
The InChIKey is PJCXUBKNGATCHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2S/c1-6-5-15-11(16-6)10(14)7-3-2-4-8(12)9(7)13/h2-5,10H,14H2,1H3.
What are the key properties of (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine?
(2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine has a molecular weight of 273.19 g/mol, XLogP of 3.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dichlorophenyl)-(5-methyl-1,3-thiazol-2-yl)methanamine is sourced from PubChem (CID 43559065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).