1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine

C10H14N4S — CID 43776721

IUPAC1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine
SMILESCc1ncsc1C(C)Nc1cnn(C)c1
InChIInChI=1S/C10H14N4S/c1-7-10(15-6-11-7)8(2)13-9-4-12-14(3)5-9/h4-6,8,13H,1-3H3
InChIKeyPQTKUAMPVQVGKF-UHFFFAOYSA-N
MW222.32 g/mol
LogP2.36
Rot. Bonds3

About 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine

1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine (PubChem CID 43776721) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine
PubChem CID43776721
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine
SMILESCc1ncsc1C(C)Nc1cnn(C)c1
InChIInChI=1S/C10H14N4S/c1-7-10(15-6-11-7)8(2)13-9-4-12-14(3)5-9/h4-6,8,13H,1-3H3
InChIKeyPQTKUAMPVQVGKF-UHFFFAOYSA-N
XLogP2.36
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine?
The IUPAC name of 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine (CID 43776721) is 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine.
What is the SMILES notation for 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine?
The canonical SMILES for 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine is Cc1ncsc1C(C)Nc1cnn(C)c1.
What is the InChIKey of 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine?
The InChIKey is PQTKUAMPVQVGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-7-10(15-6-11-7)8(2)13-9-4-12-14(3)5-9/h4-6,8,13H,1-3H3.
What are the key properties of 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine?
1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine has a molecular weight of 222.32 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrazol-4-amine is sourced from PubChem (CID 43776721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).