N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine

C11H13N3S — CID 104736641

IUPACN-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine
SMILESCNC(Cc1cccnc1)c1cncs1
InChIInChI=1S/C11H13N3S/c1-12-10(11-7-14-8-15-11)5-9-3-2-4-13-6-9/h2-4,6-8,10,12H,5H2,1H3
InChIKeyXHJUAEVODGOWHV-UHFFFAOYSA-N
MW219.31 g/mol
LogP2.04
Rot. Bonds4

About N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine

N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine (PubChem CID 104736641) has the molecular formula C11H13N3S and a molecular weight of 219.31 g/mol. Its IUPAC name is N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine
PubChem CID104736641
Molecular FormulaC11H13N3S
Molecular Weight219.31 g/mol
Exact Mass219.08
IUPAC NameN-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine
SMILESCNC(Cc1cccnc1)c1cncs1
InChIInChI=1S/C11H13N3S/c1-12-10(11-7-14-8-15-11)5-9-3-2-4-13-6-9/h2-4,6-8,10,12H,5H2,1H3
InChIKeyXHJUAEVODGOWHV-UHFFFAOYSA-N
XLogP2.04
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 105034571
2-(3,5-difluorophenyl)-N-methyl-1-(1,3-thiazol-5-yl)ethanamine
CID 105406726
2-(3,4-difluorophenyl)-N-methyl-1-(1,3-thiazol-5-yl)ethanamine
CID 82923273
N-methyl-1-(5-methylthiophen-3-yl)-2-pyridin-3-ylethanamine
CID 65104741
1-(furan-2-yl)-N-methyl-2-pyridin-3-ylethanamine
CID 63949985
2-(4-chloro-3-fluorophenyl)-N-methyl-1-(1,3-thiazol-5-yl)ethanamine
CID 107885005
N-methyl-2-pyridin-3-yl-1-(2,4,5-trimethylphenyl)ethanamine
CID 64990106
1-(3,4-dimethylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 62549735
1-(6-fluoro-1-benzothiophen-2-yl)-N-methyl-2-pyridin-3-ylethanamine
CID 105034716
1-(3-bromo-2-pyridinyl)-N-methyl-2-pyridin-3-ylethanamine
CID 113447017
N-methyl-1-naphthalen-2-yl-2-pyridin-3-ylethanamine
CID 62791095
N-methyl-1-(5-methyl-3-pyridinyl)-2-pyridin-3-ylethanamine
CID 113297193

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine?
The IUPAC name of N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine (CID 104736641) is N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine.
What is the SMILES notation for N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine?
The canonical SMILES for N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine is CNC(Cc1cccnc1)c1cncs1.
What is the InChIKey of N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine?
The InChIKey is XHJUAEVODGOWHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S/c1-12-10(11-7-14-8-15-11)5-9-3-2-4-13-6-9/h2-4,6-8,10,12H,5H2,1H3.
What are the key properties of N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine?
N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine has a molecular weight of 219.31 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine is sourced from PubChem (CID 104736641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).