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

C8H10N4S — CID 61286025

IUPAC1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
SMILESc1cc(CNCc2nccs2)[nH]n1
InChIInChI=1S/C8H10N4S/c1-2-11-12-7(1)5-9-6-8-10-3-4-13-8/h1-4,9H,5-6H2,(H,11,12)
InChIKeyFHXQJDFFTFBBKO-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.16
Rot. Bonds4

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

1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine (PubChem CID 61286025) has the molecular formula C8H10N4S and a molecular weight of 194.26 g/mol. Its IUPAC name is 1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
PubChem CID61286025
Molecular FormulaC8H10N4S
Molecular Weight194.26 g/mol
Exact Mass194.06
IUPAC Name1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
SMILESc1cc(CNCc2nccs2)[nH]n1
InChIInChI=1S/C8H10N4S/c1-2-11-12-7(1)5-9-6-8-10-3-4-13-8/h1-4,9H,5-6H2,(H,11,12)
InChIKeyFHXQJDFFTFBBKO-UHFFFAOYSA-N
XLogP1.16
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1H-pyrazol-5-yl)-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 61285482
1-(4-fluorophenyl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 60962189
1-(1H-pyrazol-5-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)methanamine
CID 60979310
1-phenyl-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 4777619
2-methyl-N-(1H-pyrazol-5-ylmethyl)propan-2-amine
CID 43662218
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1-(1H-pyrazol-5-yl)methanamine
CID 61282805
1-(1H-pyrazol-5-ylmethylamino)-2-thiophen-2-ylpropan-2-ol
CID 111440624
2-[(1,3-thiazol-2-ylmethylamino)methyl]phenol
CID 61284615
N-[(5-iodofuran-2-yl)methyl]-1-(1H-pyrazol-5-yl)methanamine
CID 61283329
N,N-dimethyl-4-[(1H-pyrazol-5-ylmethylamino)methyl]-1,3-thiazol-2-amine
CID 115671380
1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 106414886
1-(2-bromophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 61286252

Frequently Asked Questions

What is the IUPAC name of 1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The IUPAC name of 1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine (CID 61286025) is 1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine.
What is the SMILES notation for 1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The canonical SMILES for 1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine is c1cc(CNCc2nccs2)[nH]n1.
What is the InChIKey of 1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The InChIKey is FHXQJDFFTFBBKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4S/c1-2-11-12-7(1)5-9-6-8-10-3-4-13-8/h1-4,9H,5-6H2,(H,11,12).
What are the key properties of 1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine has a molecular weight of 194.26 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine is sourced from PubChem (CID 61286025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).