1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine

C10H14N4S — CID 104589102

IUPAC1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine
SMILESCCn1nccc1CNCc1cncs1
InChIInChI=1S/C10H14N4S/c1-2-14-9(3-4-13-14)5-11-6-10-7-12-8-15-10/h3-4,7-8,11H,2,5-6H2,1H3
InChIKeyUMQNHLRPBYTCBW-UHFFFAOYSA-N
MW222.32 g/mol
LogP1.65
Rot. Bonds5

About 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine

1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine (PubChem CID 104589102) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine
PubChem CID104589102
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine
SMILESCCn1nccc1CNCc1cncs1
InChIInChI=1S/C10H14N4S/c1-2-14-9(3-4-13-14)5-11-6-10-7-12-8-15-10/h3-4,7-8,11H,2,5-6H2,1H3
InChIKeyUMQNHLRPBYTCBW-UHFFFAOYSA-N
XLogP1.65
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1H-pyrazol-3-yl)-1,3-thiazole
CID 3363559
n-((2-Ethylthiazol-4-yl)methyl)-1-(1h-pyrazol-1-yl)propan-2-amine
CID 53522670
N-[(2-propyl-1,3-thiazol-4-yl)methyl]-1-pyrazol-1-ylpropan-2-amine
CID 53559006
4-(chloromethyl)-2-(1-methyl-1H-pyrazol-3-yl)-1,3-thiazole
CID 65195624
N-methyl-1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 56906535
N-[(2-methylpyrazol-3-yl)methyl]-1,3-thiazole-2-sulfonamide
CID 71912971
1-butyl-5-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrazol-4-amine
CID 75442708
1-(5-methyl-1H-pyrazol-4-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 86808836
N-[(2-ethylpyrazol-3-yl)methyl]-N-methyl-2-(4-methyl-1,3-thiazol-5-yl)ethanamine
CID 132359707
N-[[2-(1-methylpyrazol-3-yl)-1,3-thiazol-4-yl]methyl]butane-1-sulfonamide
CID 132391982
4-[(Diethylsulfamoylamino)methyl]-2-(1-methylpyrazol-3-yl)-1,3-thiazole
CID 132393963
4-[[[Methyl(propan-2-yl)sulfamoyl]amino]methyl]-2-(1-methylpyrazol-3-yl)-1,3-thiazole
CID 132393965

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine?
The IUPAC name of 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine (CID 104589102) is 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine.
What is the SMILES notation for 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine?
The canonical SMILES for 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine is CCn1nccc1CNCc1cncs1.
What is the InChIKey of 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine?
The InChIKey is UMQNHLRPBYTCBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-2-14-9(3-4-13-14)5-11-6-10-7-12-8-15-10/h3-4,7-8,11H,2,5-6H2,1H3.
What are the key properties of 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine?
1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine has a molecular weight of 222.32 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine is sourced from PubChem (CID 104589102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).