4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine

C15H15N5S — CID 103363995

IUPAC4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine
SMILESCC(Nc1snc(N)c1-c1ccncc1)c1ccncc1
InChIInChI=1S/C15H15N5S/c1-10(11-2-6-17-7-3-11)19-15-13(14(16)20-21-15)12-4-8-18-9-5-12/h2-10,19H,1H3,(H2,16,20)
InChIKeyYOPIWZCTCWANFR-UHFFFAOYSA-N
MW297.39 g/mol
LogP3.36
Rot. Bonds4

About 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine

4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine (PubChem CID 103363995) has the molecular formula C15H15N5S and a molecular weight of 297.39 g/mol. Its IUPAC name is 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine.

Molecular Properties

Compound Name4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine
PubChem CID103363995
Molecular FormulaC15H15N5S
Molecular Weight297.39 g/mol
Exact Mass297.10
IUPAC Name4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine
SMILESCC(Nc1snc(N)c1-c1ccncc1)c1ccncc1
InChIInChI=1S/C15H15N5S/c1-10(11-2-6-17-7-3-11)19-15-13(14(16)20-21-15)12-4-8-18-9-5-12/h2-10,19H,1H3,(H2,16,20)
InChIKeyYOPIWZCTCWANFR-UHFFFAOYSA-N
XLogP3.36
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.39
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(2-methyl-1,3-thiazol-4-yl)-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine
CID 103382912
5-N-(3-methylpentan-2-yl)-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
CID 103359578
5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
CID 103360020
5-N-(1-ethoxypropan-2-yl)-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
CID 103360282
2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide
CID 103359608
4-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]butan-2-ol
CID 103359777
4-pyridin-4-yl-5-N-(2,3,3-trimethylbutyl)-1,2-thiazole-3,5-diamine
CID 103365005
4-(4-methyl-1,3-thiazol-2-yl)-5-N-(1-phenylethyl)-1,2-thiazole-3,5-diamine
CID 103349504
N-methyl-1-pyridin-4-ylethanamine;dihydrochloride
CID 42921481
4-pyridin-4-yl-5-N-(1,3-thiazol-5-ylmethyl)-1,2-thiazole-3,5-diamine
CID 103365701
5-N-(3,3-dimethylcyclopentyl)-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
CID 103365630
3-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-2,2-difluoropropan-1-ol
CID 106174702

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine?
The IUPAC name of 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine (CID 103363995) is 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine.
What is the SMILES notation for 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine?
The canonical SMILES for 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine is CC(Nc1snc(N)c1-c1ccncc1)c1ccncc1.
What is the InChIKey of 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine?
The InChIKey is YOPIWZCTCWANFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5S/c1-10(11-2-6-17-7-3-11)19-15-13(14(16)20-21-15)12-4-8-18-9-5-12/h2-10,19H,1H3,(H2,16,20).
What are the key properties of 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine?
4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine has a molecular weight of 297.39 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine is sourced from PubChem (CID 103363995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).