3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol

C10H16N2OS — CID 164652915

IUPAC3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol
SMILESCC1(C)C(N)CC1(O)Cc1ccns1
InChIInChI=1S/C10H16N2OS/c1-9(2)8(11)6-10(9,13)5-7-3-4-12-14-7/h3-4,8,13H,5-6,11H2,1-2H3
InChIKeyWXMQNEPCLGNVFE-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.17
Rot. Bonds2

About 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol

3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol (PubChem CID 164652915) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol.

Molecular Properties

Compound Name3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol
PubChem CID164652915
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol
SMILESCC1(C)C(N)CC1(O)Cc1ccns1
InChIInChI=1S/C10H16N2OS/c1-9(2)8(11)6-10(9,13)5-7-3-4-12-14-7/h3-4,8,13H,5-6,11H2,1-2H3
InChIKeyWXMQNEPCLGNVFE-UHFFFAOYSA-N
XLogP1.17
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[Amino(1,2-thiazol-5-yl)methyl]-3,3-bis(fluoromethyl)cyclobutan-1-ol
CID 165594686
2-Cyclobutyl-2-methyl-1-(1,2-thiazol-5-yl)propan-1-amine
CID 130826098
2,2-Dimethyl-1-(1,2-thiazol-5-yl)cyclobutan-1-ol
CID 130856978
(1-Methoxycyclobutyl)-(1,2-thiazol-5-yl)methanamine
CID 131172129
3-Amino-2-methyl-1-(1,2-thiazol-5-yl)butan-2-ol
CID 164652909
3,3-Dimethyl-1-[(1,2-thiazol-5-yl)methyl]cyclobutan-1-ol
CID 164652912
2-(2-Methylcyclopropyl)-1-(1,2-thiazol-5-yl)propan-2-ol
CID 164652913
2-(2,2-Dimethylcyclopropyl)-1-(1,2-thiazol-5-yl)propan-2-ol
CID 164652917
6-Methyl-3-[(1,2-thiazol-5-yl)methyl]piperidin-3-ol
CID 164652918
1-[Amino(1,2-thiazol-5-yl)methyl]cyclobutan-1-ol
CID 165542346
1-[Amino(1,2-thiazol-5-yl)methyl]cyclopentan-1-ol
CID 165591787
1-Amino-2-methyl-1-(1,2-thiazol-5-yl)propan-2-ol
CID 165595427

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol?
The IUPAC name of 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol (CID 164652915) is 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol.
What is the SMILES notation for 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol?
The canonical SMILES for 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol is CC1(C)C(N)CC1(O)Cc1ccns1.
What is the InChIKey of 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol?
The InChIKey is WXMQNEPCLGNVFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-9(2)8(11)6-10(9,13)5-7-3-4-12-14-7/h3-4,8,13H,5-6,11H2,1-2H3.
What are the key properties of 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol?
3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol has a molecular weight of 212.32 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethyl-1-(1,2-thiazol-5-ylmethyl)cyclobutan-1-ol is sourced from PubChem (CID 164652915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).