N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine

C10H16BrN3S — CID 106738202

IUPACN-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine
SMILESNCC(Nc1nc(Br)cs1)C1CCCC1
InChIInChI=1S/C10H16BrN3S/c11-9-6-15-10(14-9)13-8(5-12)7-3-1-2-4-7/h6-8H,1-5,12H2,(H,13,14)
InChIKeyQUXUIBLVSYVHHN-UHFFFAOYSA-N
MW290.23 g/mol
LogP2.84
Rot. Bonds4

About N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine

N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine (PubChem CID 106738202) has the molecular formula C10H16BrN3S and a molecular weight of 290.23 g/mol. Its IUPAC name is N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine.

Molecular Properties

Compound NameN-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine
PubChem CID106738202
Molecular FormulaC10H16BrN3S
Molecular Weight290.23 g/mol
Exact Mass289.02
IUPAC NameN-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine
SMILESNCC(Nc1nc(Br)cs1)C1CCCC1
InChIInChI=1S/C10H16BrN3S/c11-9-6-15-10(14-9)13-8(5-12)7-3-1-2-4-7/h6-8H,1-5,12H2,(H,13,14)
InChIKeyQUXUIBLVSYVHHN-UHFFFAOYSA-N
XLogP2.84
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.23
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine 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-bromo-N-(1-cyclopentylpropyl)-1,3-thiazol-2-amine
CID 130765960
4-bromo-N-(1-cyclohexylethyl)-1,3-thiazol-2-amine
CID 79398777
2-[(4-bromo-1,3-thiazol-2-yl)amino]-2-cyclohexylacetic acid
CID 79399207
N-(5-bromopyrimidin-2-yl)-1-cyclopentylethane-1,2-diamine
CID 106738307
4-bromo-N-(1-cyclopropylbutan-2-yl)-1,3-thiazol-2-amine
CID 79400384
2-N-(4-bromo-1,3-thiazol-2-yl)pentane-1,2-diamine
CID 79399915
1-cyclohexyl-N-(3-propyl-1,2,4-thiadiazol-5-yl)ethane-1,2-diamine
CID 115309534
N-(2-amino-1-cyclohexylethyl)-2-(aminomethyl)-1,3-thiazole-4-carboxamide
CID 122080623
1-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)ethane-1,2-diamine
CID 106738262
N-(2-bromophenyl)-1-cyclopentylethane-1,2-diamine
CID 65385964
1-cyclohexyl-N-(6-methoxy-2-pyridinyl)ethane-1,2-diamine
CID 113283800
N-(2-amino-1-cyclohexylethyl)-2-propan-2-yl-1,3-thiazole-4-carboxamide
CID 119590933

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine?
The IUPAC name of N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine (CID 106738202) is N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine.
What is the SMILES notation for N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine?
The canonical SMILES for N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine is NCC(Nc1nc(Br)cs1)C1CCCC1.
What is the InChIKey of N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine?
The InChIKey is QUXUIBLVSYVHHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16BrN3S/c11-9-6-15-10(14-9)13-8(5-12)7-3-1-2-4-7/h6-8H,1-5,12H2,(H,13,14).
What are the key properties of N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine?
N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine has a molecular weight of 290.23 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-1,3-thiazol-2-yl)-1-cyclopentylethane-1,2-diamine is sourced from PubChem (CID 106738202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).