3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine

C10H16N2OS — CID 104587961

IUPAC3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine
SMILESCOC1CC(NCc2nc(C)cs2)C1
InChIInChI=1S/C10H16N2OS/c1-7-6-14-10(12-7)5-11-8-3-9(4-8)13-2/h6,8-9,11H,3-5H2,1-2H3
InChIKeyBFUMISWEUVMWJY-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.72
Rot. Bonds4

About 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine

3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine (PubChem CID 104587961) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine
PubChem CID104587961
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine
SMILESCOC1CC(NCc2nc(C)cs2)C1
InChIInChI=1S/C10H16N2OS/c1-7-6-14-10(12-7)5-11-8-3-9(4-8)13-2/h6,8-9,11H,3-5H2,1-2H3
InChIKeyBFUMISWEUVMWJY-UHFFFAOYSA-N
XLogP1.72
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine
CID 104587891
3-(2-methoxyphenyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine
CID 61042870
N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,1-dioxothietan-3-amine
CID 131025858
1-methyl-5-[(4-methyl-1,3-thiazol-2-yl)methylamino]piperidin-2-one
CID 78997796
4,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine
CID 60733825
3-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclobutan-1-amine
CID 104859672
N-[(4-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 61309763
1-(3,5-dimethoxyphenyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidin-3-amine
CID 71980341
2-[cyclopropylmethyl-[3-[(4-methyl-1,3-thiazol-2-yl)methylamino]cyclobutyl]amino]acetic acid
CID 122041267
1-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclobutane-1,3-diamine
CID 80562480
N-[(3-bromothiophen-2-yl)methyl]-3-methoxycyclobutan-1-amine
CID 104756829
3,5-dimethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclohexan-1-amine
CID 64752621

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine?
The IUPAC name of 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine (CID 104587961) is 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine?
The canonical SMILES for 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine is COC1CC(NCc2nc(C)cs2)C1.
What is the InChIKey of 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine?
The InChIKey is BFUMISWEUVMWJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7-6-14-10(12-7)5-11-8-3-9(4-8)13-2/h6,8-9,11H,3-5H2,1-2H3.
What are the key properties of 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine?
3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine has a molecular weight of 212.32 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 104587961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).