5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine

C14H24N4S — CID 55001985

IUPAC5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCCCCCN(c1nc2sccn2c1CN)C(C)C
InChIInChI=1S/C14H24N4S/c1-4-5-6-7-17(11(2)3)13-12(10-15)18-8-9-19-14(18)16-13/h8-9,11H,4-7,10,15H2,1-3H3
InChIKeyRQBNYYXSPZFXLP-UHFFFAOYSA-N
MW280.44 g/mol
LogP3.26
Rot. Bonds7

About 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine

5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 55001985) has the molecular formula C14H24N4S and a molecular weight of 280.44 g/mol. Its IUPAC name is 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID55001985
Molecular FormulaC14H24N4S
Molecular Weight280.44 g/mol
Exact Mass280.17
IUPAC Name5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCCCCCN(c1nc2sccn2c1CN)C(C)C
InChIInChI=1S/C14H24N4S/c1-4-5-6-7-17(11(2)3)13-12(10-15)18-8-9-19-14(18)16-13/h8-9,11H,4-7,10,15H2,1-3H3
InChIKeyRQBNYYXSPZFXLP-UHFFFAOYSA-N
XLogP3.26
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-propan-2-ylamino]propan-1-ol
CID 54994539
2-[[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-propan-2-ylamino]ethanol
CID 54995108
5-(chloromethyl)-N-propan-2-yl-N-propylimidazo[2,1-b][1,3]thiazol-6-amine
CID 43476018
5-(aminomethyl)-N,N-dipropylimidazo[2,1-b][1,3]thiazol-6-amine
CID 43476275
5-(2-aminopropyl)-N-(2-methylpropyl)-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63815676
5-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 60892756
[6-[methyl(propyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 43475992
(6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
CID 82503893
5-(2-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 55236778
2-[[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-(2-amino-2-oxoethyl)amino]acetamide
CID 62923504
5-(2-aminopropyl)-N-butyl-N-cyclopropylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63816316
5-(aminomethyl)-N-methyl-N-(oxan-4-yl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 43611472

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine (CID 55001985) is 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine is CCCCCN(c1nc2sccn2c1CN)C(C)C.
What is the InChIKey of 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is RQBNYYXSPZFXLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4S/c1-4-5-6-7-17(11(2)3)13-12(10-15)18-8-9-19-14(18)16-13/h8-9,11H,4-7,10,15H2,1-3H3.
What are the key properties of 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine?
5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 280.44 g/mol, XLogP of 3.26, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-pentyl-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 55001985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).