(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine

C10H8Cl2N2S — CID 103443950

IUPAC(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine
SMILESNC(c1ccc(Cl)s1)c1ncccc1Cl
InChIInChI=1S/C10H8Cl2N2S/c11-6-2-1-5-14-10(6)9(13)7-3-4-8(12)15-7/h1-5,9H,13H2
InChIKeyQTHCCAIDZGCUQF-UHFFFAOYSA-N
MW259.16 g/mol
LogP3.50
Rot. Bonds2

About (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine

(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine (PubChem CID 103443950) has the molecular formula C10H8Cl2N2S and a molecular weight of 259.16 g/mol. Its IUPAC name is (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine.

Molecular Properties

Compound Name(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine
PubChem CID103443950
Molecular FormulaC10H8Cl2N2S
Molecular Weight259.16 g/mol
Exact Mass257.98
IUPAC Name(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine
SMILESNC(c1ccc(Cl)s1)c1ncccc1Cl
InChIInChI=1S/C10H8Cl2N2S/c11-6-2-1-5-14-10(6)9(13)7-3-4-8(12)15-7/h1-5,9H,13H2
InChIKeyQTHCCAIDZGCUQF-UHFFFAOYSA-N
XLogP3.50
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.16
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-chlorothiophen-2-yl)-(3-methoxypyrazin-2-yl)methanamine
CID 105031917
(5-chlorothiophen-2-yl)-quinolin-5-ylmethanamine
CID 115604916
(1S)-1-(3-chloro-2-pyridinyl)ethanamine
CID 103663393
(3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine
CID 103443848
(5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine
CID 82236048
1-(3-chloro-2-pyridinyl)ethane-1,2-diamine
CID 55293817
1-(3-chloro-2-pyridinyl)prop-2-yn-1-amine
CID 103443721
(3-chloro-2-pyridinyl)-(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 103443841
1-(3-chloro-2-pyridinyl)-2,2-dimethylpropan-1-amine
CID 103852479
3-N-[1-(5-chlorothiophen-2-yl)ethyl]pyridine-2,3-diamine
CID 104540086
(3-chloro-2-pyridinyl)-quinolin-7-ylmethanamine
CID 103443918
(5-chlorothiophen-2-yl)-pyridin-2-ylmethanol
CID 79021425

Frequently Asked Questions

What is the IUPAC name of (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine?
The IUPAC name of (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine (CID 103443950) is (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine.
What is the SMILES notation for (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine?
The canonical SMILES for (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine is NC(c1ccc(Cl)s1)c1ncccc1Cl.
What is the InChIKey of (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine?
The InChIKey is QTHCCAIDZGCUQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2S/c11-6-2-1-5-14-10(6)9(13)7-3-4-8(12)15-7/h1-5,9H,13H2.
What are the key properties of (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine?
(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine has a molecular weight of 259.16 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine is sourced from PubChem (CID 103443950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).