5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine

C14H15N5S — CID 86790656

IUPAC5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine
SMILESCCc1cnc(NCc2cn[nH]c2-c2cccnc2)s1
InChIInChI=1S/C14H15N5S/c1-2-12-9-17-14(20-12)16-7-11-8-18-19-13(11)10-4-3-5-15-6-10/h3-6,8-9H,2,7H2,1H3,(H,16,17)(H,18,19)
InChIKeyVTSHJMGVLMYVPE-UHFFFAOYSA-N
MW285.38 g/mol
LogP3.10
Rot. Bonds5

About 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine

5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine (PubChem CID 86790656) has the molecular formula C14H15N5S and a molecular weight of 285.38 g/mol. Its IUPAC name is 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine
PubChem CID86790656
Molecular FormulaC14H15N5S
Molecular Weight285.38 g/mol
Exact Mass285.10
IUPAC Name5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine
SMILESCCc1cnc(NCc2cn[nH]c2-c2cccnc2)s1
InChIInChI=1S/C14H15N5S/c1-2-12-9-17-14(20-12)16-7-11-8-18-19-13(11)10-4-3-5-15-6-10/h3-6,8-9H,2,7H2,1H3,(H,16,17)(H,18,19)
InChIKeyVTSHJMGVLMYVPE-UHFFFAOYSA-N
XLogP3.10
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.38
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine with MolForge

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Related Compounds

5-propyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 75498213
N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
CID 43756710
5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine
CID 104599802
6-methyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
CID 81498728
2,2-dimethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]propan-1-amine
CID 61167800
N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]butan-2-amine
CID 43756378
2-iodo-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]aniline
CID 43773509
3-bromo-2-methyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]aniline
CID 103890740
N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]cyclobutanamine
CID 62416311
(5-pyridin-3-yl-1H-pyrazol-4-yl)methanol
CID 43753528
2,2-dimethyl-3-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanenitrile
CID 104587038
methyl 2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]acetate
CID 43756904

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine (CID 86790656) is 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine is CCc1cnc(NCc2cn[nH]c2-c2cccnc2)s1.
What is the InChIKey of 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine?
The InChIKey is VTSHJMGVLMYVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5S/c1-2-12-9-17-14(20-12)16-7-11-8-18-19-13(11)10-4-3-5-15-6-10/h3-6,8-9H,2,7H2,1H3,(H,16,17)(H,18,19).
What are the key properties of 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine?
5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine has a molecular weight of 285.38 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 86790656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).