3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine

C10H9ClN2S — CID 107360745

IUPAC3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine
SMILESNc1ncccc1Cc1sccc1Cl
InChIInChI=1S/C10H9ClN2S/c11-8-3-5-14-9(8)6-7-2-1-4-13-10(7)12/h1-5H,6H2,(H2,12,13)
InChIKeyCWSZFTOGYCFNJG-UHFFFAOYSA-N
MW224.72 g/mol
LogP2.97
Rot. Bonds2

About 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine

3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine (PubChem CID 107360745) has the molecular formula C10H9ClN2S and a molecular weight of 224.72 g/mol. Its IUPAC name is 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine
PubChem CID107360745
Molecular FormulaC10H9ClN2S
Molecular Weight224.72 g/mol
Exact Mass224.02
IUPAC Name3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine
SMILESNc1ncccc1Cc1sccc1Cl
InChIInChI=1S/C10H9ClN2S/c11-8-3-5-14-9(8)6-7-2-1-4-13-10(7)12/h1-5H,6H2,(H2,12,13)
InChIKeyCWSZFTOGYCFNJG-UHFFFAOYSA-N
XLogP2.97
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.72
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-chloro-4-methylphenyl)methyl]pyridin-2-amine
CID 106870023
3-[(3-chloro-4-methylphenyl)methyl]pyridin-2-amine
CID 107560925
3-[2-amino-2-(3-chloro-2-pyridinyl)ethyl]pyridin-2-amine
CID 103443859
3-[(4-chloro-1-ethylpyrazol-5-yl)methyl]pyridin-2-amine
CID 114663382
3-[(4-bromo-3-chloro-2-fluorophenyl)methyl]pyridin-2-amine
CID 106763395
2-(2-amino-3-pyridinyl)-1-(3-chloro-2-pyridinyl)ethanone
CID 103443047
3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine
CID 116811036
2-(2-amino-3-pyridinyl)-1-(3-bromothiophen-2-yl)ethanol
CID 115380906
3-prop-2-enylpyridin-2-amine
CID 22022139
3-(2-methylpropyl)pyridin-2-amine
CID 20771927
ethane;3-propylpyridin-2-amine
CID 176926436
3-[2-(3-chloro-2-pyridinyl)-2-hydrazinylethyl]pyridin-2-amine
CID 103445799

Frequently Asked Questions

What is the IUPAC name of 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine (CID 107360745) is 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine is Nc1ncccc1Cc1sccc1Cl.
What is the InChIKey of 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine?
The InChIKey is CWSZFTOGYCFNJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2S/c11-8-3-5-14-9(8)6-7-2-1-4-13-10(7)12/h1-5H,6H2,(H2,12,13).
What are the key properties of 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine?
3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine has a molecular weight of 224.72 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-chlorothiophen-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 107360745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).