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

C11H16N4S — CID 115888868

IUPAC1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine
SMILESCc1ncc(C(C)NCCn2cccn2)s1
InChIInChI=1S/C11H16N4S/c1-9(11-8-13-10(2)16-11)12-5-7-15-6-3-4-14-15/h3-4,6,8-9,12H,5,7H2,1-2H3
InChIKeyYVEBNKRKBQOSPB-UHFFFAOYSA-N
MW236.34 g/mol
LogP2.00
Rot. Bonds5

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

1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine (PubChem CID 115888868) has the molecular formula C11H16N4S and a molecular weight of 236.34 g/mol. Its IUPAC name is 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine.

Molecular Properties

Compound Name1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine
PubChem CID115888868
Molecular FormulaC11H16N4S
Molecular Weight236.34 g/mol
Exact Mass236.11
IUPAC Name1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine
SMILESCc1ncc(C(C)NCCn2cccn2)s1
InChIInChI=1S/C11H16N4S/c1-9(11-8-13-10(2)16-11)12-5-7-15-6-3-4-14-15/h3-4,6,8-9,12H,5,7H2,1-2H3
InChIKeyYVEBNKRKBQOSPB-UHFFFAOYSA-N
XLogP2.00
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-methyl-1,3-thiazol-4-yl)-N-(2-pyrazol-1-ylethyl)ethanamine
CID 61459875
N',N'-diethyl-N-[1-(2-methyl-1,3-thiazol-5-yl)ethyl]ethane-1,2-diamine
CID 115777798
(1R)-1-(2-methylphenyl)-N-(2-pyrazol-1-ylethyl)ethanamine
CID 81374023
1-chloro-N-(2-pyrazol-1-ylethyl)propan-2-amine
CID 65025560
1-(4-tert-butylphenyl)-N-(2-pyrazol-1-ylethyl)ethanamine
CID 61459928
1-(5-fluoro-2-pyridinyl)-N-(2-pyrazol-1-ylethyl)ethanamine
CID 83117451
4-ethoxy-N-[1-(2-methyl-1,3-thiazol-5-yl)ethyl]butan-1-amine
CID 115777834
N-[1-(4-propan-2-ylphenyl)ethyl]-3-pyrazol-1-ylpropan-1-amine
CID 115708568
1-(3-fluorophenyl)-N-(2-pyrazol-1-ylethyl)ethanamine
CID 56828853
3-[1-(2-pyrazol-1-ylethylamino)ethyl]phenol
CID 54951683
N-[2-(2-methylprop-2-enoxy)ethyl]-1-(2-methyl-1,3-thiazol-5-yl)ethanamine
CID 115894187
2-methyl-N-(2-pyrazol-1-ylethyl)pentan-3-amine
CID 61459650

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine?
The IUPAC name of 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine (CID 115888868) is 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine.
What is the SMILES notation for 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine?
The canonical SMILES for 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine is Cc1ncc(C(C)NCCn2cccn2)s1.
What is the InChIKey of 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine?
The InChIKey is YVEBNKRKBQOSPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4S/c1-9(11-8-13-10(2)16-11)12-5-7-15-6-3-4-14-15/h3-4,6,8-9,12H,5,7H2,1-2H3.
What are the key properties of 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine?
1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine has a molecular weight of 236.34 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1,3-thiazol-5-yl)-N-(2-pyrazol-1-ylethyl)ethanamine is sourced from PubChem (CID 115888868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).