N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine

C14H14N4S — CID 59088603

IUPACN-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine
SMILESCNc1nc(-c2cnn(-c3ccccc3)c2C)cs1
InChIInChI=1S/C14H14N4S/c1-10-12(13-9-19-14(15-2)17-13)8-16-18(10)11-6-4-3-5-7-11/h3-9H,1-2H3,(H,15,17)
InChIKeySFDBTWMGNYRJPW-UHFFFAOYSA-N
MW270.36 g/mol
LogP3.35
Rot. Bonds3

About N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine

N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine (PubChem CID 59088603) has the molecular formula C14H14N4S and a molecular weight of 270.36 g/mol. Its IUPAC name is N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine
PubChem CID59088603
Molecular FormulaC14H14N4S
Molecular Weight270.36 g/mol
Exact Mass270.09
IUPAC NameN-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine
SMILESCNc1nc(-c2cnn(-c3ccccc3)c2C)cs1
InChIInChI=1S/C14H14N4S/c1-10-12(13-9-19-14(15-2)17-13)8-16-18(10)11-6-4-3-5-7-11/h3-9H,1-2H3,(H,15,17)
InChIKeySFDBTWMGNYRJPW-UHFFFAOYSA-N
XLogP3.35
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Adx88178
CID 46836872
N-[4-(1H-pyrazol-4-yl)-1,3-thiazol-2-yl]pyridin-2-amine
CID 42645487
6-Phenyl-4,5-dihydropyrazolo[4,3-e][1,3]benzothiazol-2-amine
CID 712700
N-(phenylmethyl)-4-(3-pyridinyl)-2-thiazolamine
CID 746646
1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-4-(2-pyridinyl)-1H-pyrazol-5-amine
CID 1474437
4-(1,5-Dimethyl-1H-pyrazol-4-yl)-thiazol-2-ylamine
CID 6485377
N-phenyl-4-pyridin-4-yl-2-thiazolamine
CID 746609
5-methyl-4-(1H-pyrazol-4-yl)-N-(pyridin-2-yl)thiazol-2-amine
CID 25138329
4-(5-methyl-1H-pyrazol-4-yl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 42644808
N-(6-methyl-2-pyridinyl)-5-thia-3,11,12-triazatricyclo[8.3.0.02,6]trideca-1(10),2(6),3,12-tetraen-4-amine
CID 46836565
2-N-ethyl-6-N-(5-thia-3,11,12-triazatricyclo[8.3.0.02,6]trideca-1(10),2(6),3,12-tetraen-4-yl)pyridine-2,6-diamine
CID 53388196
3-[[4-methyl-5-(4-pyrazol-1-ylphenyl)-1,3-thiazol-2-yl]carbamoylamino]-N-(3-methyl-2H-pyrrol-5-yl)propanamide
CID 58532021

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine (CID 59088603) is N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine is CNc1nc(-c2cnn(-c3ccccc3)c2C)cs1.
What is the InChIKey of N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine?
The InChIKey is SFDBTWMGNYRJPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4S/c1-10-12(13-9-19-14(15-2)17-13)8-16-18(10)11-6-4-3-5-7-11/h3-9H,1-2H3,(H,15,17).
What are the key properties of N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine?
N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine has a molecular weight of 270.36 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 59088603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).