N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine

C16H25N3S — CID 83159614

IUPACN-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine
SMILESCC(C)(C)NCC(C)(Cc1cn2ccsc2n1)C1CC1
InChIInChI=1S/C16H25N3S/c1-15(2,3)17-11-16(4,12-5-6-12)9-13-10-19-7-8-20-14(19)18-13/h7-8,10,12,17H,5-6,9,11H2,1-4H3
InChIKeyONVDDCMTOBKQHE-UHFFFAOYSA-N
MW291.46 g/mol
LogP3.74
Rot. Bonds5

About N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine

N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine (PubChem CID 83159614) has the molecular formula C16H25N3S and a molecular weight of 291.46 g/mol. Its IUPAC name is N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine
PubChem CID83159614
Molecular FormulaC16H25N3S
Molecular Weight291.46 g/mol
Exact Mass291.18
IUPAC NameN-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine
SMILESCC(C)(C)NCC(C)(Cc1cn2ccsc2n1)C1CC1
InChIInChI=1S/C16H25N3S/c1-15(2,3)17-11-16(4,12-5-6-12)9-13-10-19-7-8-20-14(19)18-13/h7-8,10,12,17H,5-6,9,11H2,1-4H3
InChIKeyONVDDCMTOBKQHE-UHFFFAOYSA-N
XLogP3.74
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.46
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methylbut-3-enyl]cyclopropanamine
CID 102641228
N-tert-butyl-4-imidazo[2,1-b][1,3]thiazol-6-yl-3-methylbutan-1-amine
CID 113289512
2-cyclopropyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylcarbamoylamino)propanoic acid
CID 115331403
6-[3-chloro-2-(chloromethyl)-2-cyclopentylpropyl]imidazo[2,1-b][1,3]thiazole
CID 112571066
1-imidazo[2,1-b][1,3]thiazol-6-yl-2-methyl-3-(2-methylpropylamino)propan-2-ol
CID 113289464
N-[[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrrol-3-yl]methyl]-2-methylpropan-2-amine
CID 115332686
6-[(2-bromo-5-tert-butylcyclohexyl)methyl]imidazo[2,1-b][1,3]thiazole
CID 115334166
1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine
CID 115333007
6-[2-(chloromethyl)-2-ethylbutyl]imidazo[2,1-b][1,3]thiazole
CID 115335151
2-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine
CID 115334306
2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-propan-2-ylpropane-1,3-diol
CID 115335237
N-[[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-methylpyrazol-4-yl]methyl]-2-methylpropan-2-amine
CID 115334632

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine?
The IUPAC name of N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine (CID 83159614) is N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine.
What is the SMILES notation for N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine?
The canonical SMILES for N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine is CC(C)(C)NCC(C)(Cc1cn2ccsc2n1)C1CC1.
What is the InChIKey of N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine?
The InChIKey is ONVDDCMTOBKQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3S/c1-15(2,3)17-11-16(4,12-5-6-12)9-13-10-19-7-8-20-14(19)18-13/h7-8,10,12,17H,5-6,9,11H2,1-4H3.
What are the key properties of N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine?
N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine has a molecular weight of 291.46 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-cyclopropyl-3-imidazo[2,1-b][1,3]thiazol-6-yl-2-methylpropan-1-amine is sourced from PubChem (CID 83159614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).