1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine

C11H17N3OS — CID 102653432

IUPAC1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine
SMILESCNC(C1=CCCO1)c1snnc1C(C)C
InChIInChI=1S/C11H17N3OS/c1-7(2)9-11(16-14-13-9)10(12-3)8-5-4-6-15-8/h5,7,10,12H,4,6H2,1-3H3
InChIKeyFZTLPMYEUHOUNI-UHFFFAOYSA-N
MW239.34 g/mol
LogP2.23
Rot. Bonds4

About 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine

1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine (PubChem CID 102653432) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine
PubChem CID102653432
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC Name1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine
SMILESCNC(C1=CCCO1)c1snnc1C(C)C
InChIInChI=1S/C11H17N3OS/c1-7(2)9-11(16-14-13-9)10(12-3)8-5-4-6-15-8/h5,7,10,12H,4,6H2,1-3H3
InChIKeyFZTLPMYEUHOUNI-UHFFFAOYSA-N
XLogP2.23
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(4-propan-2-ylphenyl)-1-(4-propan-2-ylthiadiazol-5-yl)methanamine
CID 105144852
N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)ethanamine
CID 105082276
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
CID 102652299
1-(3-bromothiophen-2-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine
CID 105173067
1-(2,3-dihydrofuran-5-yl)-1-(3,5-dimethylphenyl)-N-methylmethanamine
CID 102653596
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(5-methylpyrazin-2-yl)methanamine
CID 102653543
1-(5-bromothiophen-3-yl)-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine
CID 102652893
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 102651314
1-(3,4-dichlorophenyl)-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine
CID 102652031
1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine
CID 102651545
1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine
CID 102651911
1-(2,3-dihydrofuran-5-yl)-1-(furan-3-yl)-N-methylmethanamine
CID 102651572

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine (CID 102653432) is 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine is CNC(C1=CCCO1)c1snnc1C(C)C.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine?
The InChIKey is FZTLPMYEUHOUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-7(2)9-11(16-14-13-9)10(12-3)8-5-4-6-15-8/h5,7,10,12H,4,6H2,1-3H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine?
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine has a molecular weight of 239.34 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine is sourced from PubChem (CID 102653432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).