4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine

C12H22N4S — CID 65484061

IUPAC4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
SMILESCCCN1CCN(CCc2csc(N)n2)CC1
InChIInChI=1S/C12H22N4S/c1-2-4-15-6-8-16(9-7-15)5-3-11-10-17-12(13)14-11/h10H,2-9H2,1H3,(H2,13,14)
InChIKeyXJXHGZVRJDDRFX-UHFFFAOYSA-N
MW254.40 g/mol
LogP1.30
Rot. Bonds5

About 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine

4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine (PubChem CID 65484061) has the molecular formula C12H22N4S and a molecular weight of 254.40 g/mol. Its IUPAC name is 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
PubChem CID65484061
Molecular FormulaC12H22N4S
Molecular Weight254.40 g/mol
Exact Mass254.16
IUPAC Name4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
SMILESCCCN1CCN(CCc2csc(N)n2)CC1
InChIInChI=1S/C12H22N4S/c1-2-4-15-6-8-16(9-7-15)5-3-11-10-17-12(13)14-11/h10H,2-9H2,1H3,(H2,13,14)
InChIKeyXJXHGZVRJDDRFX-UHFFFAOYSA-N
XLogP1.30
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.40
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(4-butan-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
CID 65484466
4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine
CID 65484449
4-(2-piperazin-1-ylethyl)-1,3-thiazol-2-amine
CID 82508561
4-[2-(2,5-dihydropyrrol-1-yl)ethyl]-1,3-thiazol-2-amine
CID 130735866
4-[2-[4-(methoxymethyl)piperidin-1-yl]ethyl]-1,3-thiazol-2-amine
CID 65484861
ethane;4-propyl-1,3-thiazol-2-amine
CID 155733982
4-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)ethyl]-1,3-thiazol-2-amine
CID 65482915
4-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-1,3-thiazol-2-amine
CID 65483300
4-(chloromethyl)-2-[3-(4-propylpiperazin-1-yl)propyl]-1,3-thiazole
CID 43320470
4-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]-1,3-thiazol-2-amine
CID 65484662
4-[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine
CID 65483873
4-[(4,4-diethylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 55166232

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine (CID 65484061) is 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine is CCCN1CCN(CCc2csc(N)n2)CC1.
What is the InChIKey of 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
The InChIKey is XJXHGZVRJDDRFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4S/c1-2-4-15-6-8-16(9-7-15)5-3-11-10-17-12(13)14-11/h10H,2-9H2,1H3,(H2,13,14).
What are the key properties of 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine has a molecular weight of 254.40 g/mol, XLogP of 1.30, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 65484061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).