4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine

C15H22N2S — CID 8900392

IUPAC4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCN(C)c1nc(C23CC4CC(CC(C4)C2)C3)cs1
InChIInChI=1S/C15H22N2S/c1-17(2)14-16-13(9-18-14)15-6-10-3-11(7-15)5-12(4-10)8-15/h9-12H,3-8H2,1-2H3
InChIKeyFAZPJCDHGWIYGC-UHFFFAOYSA-N
MW262.42 g/mol
LogP3.68
Rot. Bonds2

About 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine

4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine (PubChem CID 8900392) has the molecular formula C15H22N2S and a molecular weight of 262.42 g/mol. Its IUPAC name is 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine
PubChem CID8900392
Molecular FormulaC15H22N2S
Molecular Weight262.42 g/mol
Exact Mass262.15
IUPAC Name4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCN(C)c1nc(C23CC4CC(CC(C4)C2)C3)cs1
InChIInChI=1S/C15H22N2S/c1-17(2)14-16-13(9-18-14)15-6-10-3-11(7-15)5-12(4-10)8-15/h9-12H,3-8H2,1-2H3
InChIKeyFAZPJCDHGWIYGC-UHFFFAOYSA-N
XLogP3.68
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.42
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1-adamantyl)-N-methyl-1,3-thiazol-2-amine
CID 2872194
4-(1-Adamantyl)-1,3-thiazol-2-amine
CID 616434
4-(3-Chloro-1-adamantyl)-1,3-thiazol-2-amine
CID 3847334
4-Adamantan-1-ylmethyl-thiazol-2-ylamine
CID 2836061
4-(1-Adamantyl)-2-methylthiazole
CID 2747363
4-(1-Adamantyl)-2-aminothiazole hydrochloride
CID 2828153
4-(1-adamantyl)-N-ethyl-1,3-thiazol-2-amine
CID 2834325
4-Tricyclo[4.3.1.1*3,8*]undec-1-yl-thiazol-2-ylamine
CID 4137288
4-(1-Adamantyl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole
CID 4838460
4-(1-adamantyl)-N-ethyl-1,3-thiazol-2-amine Hydrochloride
CID 2834326
N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-3-(dimethylamino)propanamide
CID 42598253
N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N',N'-diethylethane-1,2-diamine
CID 4839146

Frequently Asked Questions

What is the IUPAC name of 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine?
The IUPAC name of 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine (CID 8900392) is 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine is CN(C)c1nc(C23CC4CC(CC(C4)C2)C3)cs1.
What is the InChIKey of 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine?
The InChIKey is FAZPJCDHGWIYGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2S/c1-17(2)14-16-13(9-18-14)15-6-10-3-11(7-15)5-12(4-10)8-15/h9-12H,3-8H2,1-2H3.
What are the key properties of 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine?
4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine has a molecular weight of 262.42 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-adamantyl)-N,N-dimethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 8900392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).