5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine

C9H8ClN3S — CID 130834562

IUPAC5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine
SMILESNc1cncc(Nc2ccsc2Cl)c1
InChIInChI=1S/C9H8ClN3S/c10-9-8(1-2-14-9)13-7-3-6(11)4-12-5-7/h1-5,13H,11H2
InChIKeyFFZGVPJPAWYROI-UHFFFAOYSA-N
MW225.70 g/mol
LogP3.12
Rot. Bonds2

About 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine

5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine (PubChem CID 130834562) has the molecular formula C9H8ClN3S and a molecular weight of 225.70 g/mol. Its IUPAC name is 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine
PubChem CID130834562
Molecular FormulaC9H8ClN3S
Molecular Weight225.70 g/mol
Exact Mass225.01
IUPAC Name5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine
SMILESNc1cncc(Nc2ccsc2Cl)c1
InChIInChI=1S/C9H8ClN3S/c10-9-8(1-2-14-9)13-7-3-6(11)4-12-5-7/h1-5,13H,11H2
InChIKeyFFZGVPJPAWYROI-UHFFFAOYSA-N
XLogP3.12
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.70
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine
CID 103481979
5-N-(2-bromophenyl)pyridine-3,5-diamine
CID 104532355
5-N-[4-chloro-2-(trifluoromethyl)phenyl]pyridine-3,5-diamine
CID 104532239
5-N-(2,4-difluorophenyl)pyridine-3,5-diamine
CID 104532376
5-N-naphthalen-1-ylpyridine-3,5-diamine
CID 104532218
5-N-(2,3,5-trifluorophenyl)pyridine-3,5-diamine
CID 113423984
(2-chlorothiophen-3-yl)hydrazine
CID 131113782
2-[(5-amino-3-pyridinyl)amino]-4-bromobenzonitrile
CID 107801738
5-N-(1,3-benzothiazol-6-yl)pyridine-3,5-diamine
CID 107801971
2-N-(2-chlorothiophen-3-yl)pyrimidine-2,4-diamine
CID 130949775
5-N-(5-bromo-2-methoxyphenyl)pyridine-3,5-diamine
CID 113423853
5-N-(3-bromophenyl)pyridine-3,5-diamine
CID 104532361

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine?
The IUPAC name of 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine (CID 130834562) is 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine.
What is the SMILES notation for 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine?
The canonical SMILES for 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine is Nc1cncc(Nc2ccsc2Cl)c1.
What is the InChIKey of 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine?
The InChIKey is FFZGVPJPAWYROI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3S/c10-9-8(1-2-14-9)13-7-3-6(11)4-12-5-7/h1-5,13H,11H2.
What are the key properties of 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine?
5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine has a molecular weight of 225.70 g/mol, XLogP of 3.12, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine is sourced from PubChem (CID 130834562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).