(5-methylthiophen-2-yl)-pyridin-3-ylmethanamine

C11H12N2S — CID 43198853

IUPAC(5-methylthiophen-2-yl)-pyridin-3-ylmethanamine
SMILESCc1ccc(C(N)c2cccnc2)s1
InChIInChI=1S/C11H12N2S/c1-8-4-5-10(14-8)11(12)9-3-2-6-13-7-9/h2-7,11H,12H2,1H3
InChIKeyZMLOSJWDTIFGFK-UHFFFAOYSA-N
MW204.30 g/mol
LogP2.50
Rot. Bonds2

About (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine

(5-methylthiophen-2-yl)-pyridin-3-ylmethanamine (PubChem CID 43198853) has the molecular formula C11H12N2S and a molecular weight of 204.30 g/mol. Its IUPAC name is (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine.

Molecular Properties

Compound Name(5-methylthiophen-2-yl)-pyridin-3-ylmethanamine
PubChem CID43198853
Molecular FormulaC11H12N2S
Molecular Weight204.30 g/mol
Exact Mass204.07
IUPAC Name(5-methylthiophen-2-yl)-pyridin-3-ylmethanamine
SMILESCc1ccc(C(N)c2cccnc2)s1
InChIInChI=1S/C11H12N2S/c1-8-4-5-10(14-8)11(12)9-3-2-6-13-7-9/h2-7,11H,12H2,1H3
InChIKeyZMLOSJWDTIFGFK-UHFFFAOYSA-N
XLogP2.50
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-methoxy-3-pyridinyl)-(5-methylthiophen-2-yl)methanamine
CID 105026193
(5-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methanamine
CID 105027557
3-[1-[5-(1-pyridin-3-ylethyl)thiophen-2-yl]ethyl]pyridine
CID 142174825
ethane;pyridin-3-yl(pyrimidin-5-yl)methanamine
CID 145185117
(3-methylthiophen-2-yl)-pyridin-3-ylmethanamine
CID 78973972
phenyl(pyridin-3-yl)methanamine;hydrochloride
CID 23724449
(4-iodophenyl)-(5-methylthiophen-2-yl)methanamine
CID 43124884
(1S,2S)-1,2-dipyridin-3-ylethane-1,2-diamine
CID 30682697
(5-methylfuran-3-yl)-pyridin-3-ylmethanamine
CID 115799285
(1R)-1-pyridin-3-ylethanamine;hydrochloride
CID 53487230
(2-methylpyrimidin-4-yl)-pyridin-3-ylmethanamine
CID 115530395
(R)-(4-bromophenyl)-pyridin-3-ylmethanamine
CID 42137795

Frequently Asked Questions

What is the IUPAC name of (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine?
The IUPAC name of (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine (CID 43198853) is (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine.
What is the SMILES notation for (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine?
The canonical SMILES for (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine is Cc1ccc(C(N)c2cccnc2)s1.
What is the InChIKey of (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine?
The InChIKey is ZMLOSJWDTIFGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S/c1-8-4-5-10(14-8)11(12)9-3-2-6-13-7-9/h2-7,11H,12H2,1H3.
What are the key properties of (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine?
(5-methylthiophen-2-yl)-pyridin-3-ylmethanamine has a molecular weight of 204.30 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylthiophen-2-yl)-pyridin-3-ylmethanamine is sourced from PubChem (CID 43198853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).