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

C15H21N5S — CID 14839505

IUPAC4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1CCN1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H21N5S/c1-12-13(21-15(16)18-12)5-7-19-8-10-20(11-9-19)14-4-2-3-6-17-14/h2-4,6H,5,7-11H2,1H3,(H2,16,18)
InChIKeyZJJBLTLQUOYGSM-UHFFFAOYSA-N
MW303.44 g/mol
LogP1.79
Rot. Bonds4

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

4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine (PubChem CID 14839505) has the molecular formula C15H21N5S and a molecular weight of 303.44 g/mol. Its IUPAC name is 4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
PubChem CID14839505
Molecular FormulaC15H21N5S
Molecular Weight303.44 g/mol
Exact Mass303.15
IUPAC Name4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1CCN1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H21N5S/c1-12-13(21-15(16)18-12)5-7-19-8-10-20(11-9-19)14-4-2-3-6-17-14/h2-4,6H,5,7-11H2,1H3,(H2,16,18)
InChIKeyZJJBLTLQUOYGSM-UHFFFAOYSA-N
XLogP1.79
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.44
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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1-(2-bromoethyl)-4-pyridin-2-ylpiperazine
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(2S)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-amine
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4-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]morpholine
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CID 110678855
7-(4-pyridin-2-ylpiperazin-1-yl)heptan-1-amine
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4,5-dimethyl-2-(4-pyridin-2-ylpiperazin-1-yl)-1,3-thiazole
CID 171335410
methanamine;1-methyl-4-pyridin-2-ylpiperazine
CID 145148686
N-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]aniline
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CID 68740274

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine (CID 14839505) is 4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine is Cc1nc(N)sc1CCN1CCN(c2ccccn2)CC1.
What is the InChIKey of 4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
The InChIKey is ZJJBLTLQUOYGSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5S/c1-12-13(21-15(16)18-12)5-7-19-8-10-20(11-9-19)14-4-2-3-6-17-14/h2-4,6H,5,7-11H2,1H3,(H2,16,18).
What are the key properties of 4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine has a molecular weight of 303.44 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 14839505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).