2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine

C14H25N5S — CID 103189987

IUPAC2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine
SMILESCCN(c1nc2sccn2c1CNC)C(C)CN(C)C
InChIInChI=1S/C14H25N5S/c1-6-18(11(2)10-17(4)5)13-12(9-15-3)19-7-8-20-14(19)16-13/h7-8,11,15H,6,9-10H2,1-5H3
InChIKeyXOPXANVAQASGCF-UHFFFAOYSA-N
MW295.46 g/mol
LogP1.89
Rot. Bonds7

About 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine

2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine (PubChem CID 103189987) has the molecular formula C14H25N5S and a molecular weight of 295.46 g/mol. Its IUPAC name is 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine
PubChem CID103189987
Molecular FormulaC14H25N5S
Molecular Weight295.46 g/mol
Exact Mass295.18
IUPAC Name2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine
SMILESCCN(c1nc2sccn2c1CNC)C(C)CN(C)C
InChIInChI=1S/C14H25N5S/c1-6-18(11(2)10-17(4)5)13-12(9-15-3)19-7-8-20-14(19)16-13/h7-8,11,15H,6,9-10H2,1-5H3
InChIKeyXOPXANVAQASGCF-UHFFFAOYSA-N
XLogP1.89
TPSA35.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.46
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-5-(methylaminomethyl)-N-propylimidazo[2,1-b][1,3]thiazol-6-amine
CID 43476472
2-N-ethyl-1-N,1-N-dimethyl-2-N-[3-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]propane-1,2-diamine
CID 103190021
N-methyl-5-(methylaminomethyl)-N-(2-methylsulfonylethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 79850296
N-methyl-5-(methylaminomethyl)-N-(oxan-4-yl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 43611473
N-butan-2-yl-N-methyl-5-[(propan-2-ylamino)methyl]imidazo[2,1-b][1,3]thiazol-6-amine
CID 43476481
N-butan-2-yl-5-(ethylaminomethyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 43476483
N,N-bis(2-methoxyethyl)-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 61418301
N-cyclopropyl-5-(methylaminomethyl)-N-propylimidazo[2,1-b][1,3]thiazol-6-amine
CID 43476466
5-(chloromethyl)-N-propan-2-yl-N-propylimidazo[2,1-b][1,3]thiazol-6-amine
CID 43476018
5-[(tert-butylamino)methyl]-N-ethyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 55148570
N-methyl-5-(methylaminomethyl)-N-[(1-methylpiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazol-6-amine
CID 63236687
5-(2-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 55236778

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine?
The IUPAC name of 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine (CID 103189987) is 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine is CCN(c1nc2sccn2c1CNC)C(C)CN(C)C.
What is the InChIKey of 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine?
The InChIKey is XOPXANVAQASGCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5S/c1-6-18(11(2)10-17(4)5)13-12(9-15-3)19-7-8-20-14(19)16-13/h7-8,11,15H,6,9-10H2,1-5H3.
What are the key properties of 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine?
2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine has a molecular weight of 295.46 g/mol, XLogP of 1.89, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine is sourced from PubChem (CID 103189987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).