N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine

C12H14N2S — CID 115916926

IUPACN-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine
SMILESCc1ccsc1C(C)Nc1ccccn1
InChIInChI=1S/C12H14N2S/c1-9-6-8-15-12(9)10(2)14-11-5-3-4-7-13-11/h3-8,10H,1-2H3,(H,13,14)
InChIKeyMANPTKZJKQCIHM-UHFFFAOYSA-N
MW218.32 g/mol
LogP3.62
Rot. Bonds3

About N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine

N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine (PubChem CID 115916926) has the molecular formula C12H14N2S and a molecular weight of 218.32 g/mol. Its IUPAC name is N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine
PubChem CID115916926
Molecular FormulaC12H14N2S
Molecular Weight218.32 g/mol
Exact Mass218.09
IUPAC NameN-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine
SMILESCc1ccsc1C(C)Nc1ccccn1
InChIInChI=1S/C12H14N2S/c1-9-6-8-15-12(9)10(2)14-11-5-3-4-7-13-11/h3-8,10H,1-2H3,(H,13,14)
InChIKeyMANPTKZJKQCIHM-UHFFFAOYSA-N
XLogP3.62
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-methylthiophen-2-yl)ethyl]quinolin-8-amine
CID 63991411
(1S)-1-(3-methylthiophen-2-yl)-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine
CID 97073226
(3-methylthiophen-2-yl)-pyridin-2-ylmethanamine
CID 79989254
5-chloro-N-[1-(3-methylthiophen-2-yl)ethyl]quinolin-8-amine
CID 63993460
N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine
CID 63993044
N-[1-(1,3-thiazol-5-yl)ethyl]pyridin-2-amine
CID 115916957
N-[1-(3-methylthiophen-2-yl)ethyl]quinolin-3-amine
CID 63991660
N-[(3-methyl-2-pyridinyl)methyl]-1-(3-methylthiophen-2-yl)ethanamine
CID 63992103
N-[1-(3-methylphenyl)ethyl]pyridin-2-amine
CID 115916909
2-(3-methylthiophen-2-yl)-2-pyridin-2-ylacetic acid
CID 116824724
1-(pyridin-2-ylamino)ethanol
CID 20521375
2-(2-methoxyethyl)-N-[1-(3-methylthiophen-2-yl)ethyl]aniline
CID 102848964

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine?
The IUPAC name of N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine (CID 115916926) is N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine?
The canonical SMILES for N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine is Cc1ccsc1C(C)Nc1ccccn1.
What is the InChIKey of N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine?
The InChIKey is MANPTKZJKQCIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S/c1-9-6-8-15-12(9)10(2)14-11-5-3-4-7-13-11/h3-8,10H,1-2H3,(H,13,14).
What are the key properties of N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine?
N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine has a molecular weight of 218.32 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 115916926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).