N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine

C15H26N4S — CID 82514904

IUPACN-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine
SMILESCCN1CCN(c2nc(CNC3CCCC3)cs2)CC1
InChIInChI=1S/C15H26N4S/c1-2-18-7-9-19(10-8-18)15-17-14(12-20-15)11-16-13-5-3-4-6-13/h12-13,16H,2-11H2,1H3
InChIKeyMWGXIFJLNSAUMB-UHFFFAOYSA-N
MW294.47 g/mol
LogP2.32
Rot. Bonds5

About N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine

N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine (PubChem CID 82514904) has the molecular formula C15H26N4S and a molecular weight of 294.47 g/mol. Its IUPAC name is N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine.

Molecular Properties

Compound NameN-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine
PubChem CID82514904
Molecular FormulaC15H26N4S
Molecular Weight294.47 g/mol
Exact Mass294.19
IUPAC NameN-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine
SMILESCCN1CCN(c2nc(CNC3CCCC3)cs2)CC1
InChIInChI=1S/C15H26N4S/c1-2-18-7-9-19(10-8-18)15-17-14(12-20-15)11-16-13-5-3-4-6-13/h12-13,16H,2-11H2,1H3
InChIKeyMWGXIFJLNSAUMB-UHFFFAOYSA-N
XLogP2.32
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.47
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(bromomethyl)-2-(4-ethylpiperazin-1-yl)-1,3-thiazole
CID 82514901
N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 55113480
N-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexanamine
CID 28780749
4-[4-[(cyclopropylamino)methyl]-1,3-thiazol-2-yl]morpholine-2-carbonitrile
CID 79681534
N-[[2-(4-ethylpiperazin-1-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 82441928
N-[(2-cyclopentyl-1,3-thiazol-4-yl)methyl]cyclopropanamine
CID 61280289
N-(1-ethylpiperidin-4-yl)-2-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]acetamide
CID 86993362
2-[4-(4-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]acetonitrile
CID 63337322
1-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-amine
CID 43215967
N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]cyclopropanamine
CID 62961582
N-[[2-(4-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]butan-1-amine
CID 82514954
1-ethyl-N-(1,3-thiazol-2-ylmethyl)azepan-4-amine
CID 65073772

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine?
The IUPAC name of N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine (CID 82514904) is N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine.
What is the SMILES notation for N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine?
The canonical SMILES for N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine is CCN1CCN(c2nc(CNC3CCCC3)cs2)CC1.
What is the InChIKey of N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine?
The InChIKey is MWGXIFJLNSAUMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4S/c1-2-18-7-9-19(10-8-18)15-17-14(12-20-15)11-16-13-5-3-4-6-13/h12-13,16H,2-11H2,1H3.
What are the key properties of N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine?
N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine has a molecular weight of 294.47 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]methyl]cyclopentanamine is sourced from PubChem (CID 82514904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).