6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine

C7H10N2OS — CID 43608929

IUPAC6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine
SMILESNCc1nc2c(s1)COCC2
InChIInChI=1S/C7H10N2OS/c8-3-7-9-5-1-2-10-4-6(5)11-7/h1-4,8H2
InChIKeyAWNQOWYGJYYQCI-UHFFFAOYSA-N
MW170.24 g/mol
LogP0.67
Rot. Bonds1

About 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine

6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine (PubChem CID 43608929) has the molecular formula C7H10N2OS and a molecular weight of 170.24 g/mol. Its IUPAC name is 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine.

Molecular Properties

Compound Name6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine
PubChem CID43608929
Molecular FormulaC7H10N2OS
Molecular Weight170.24 g/mol
Exact Mass170.05
IUPAC Name6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine
SMILESNCc1nc2c(s1)COCC2
InChIInChI=1S/C7H10N2OS/c8-3-7-9-5-1-2-10-4-6(5)11-7/h1-4,8H2
InChIKeyAWNQOWYGJYYQCI-UHFFFAOYSA-N
XLogP0.67
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.24
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine?
The IUPAC name of 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine (CID 43608929) is 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine.
What is the SMILES notation for 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine?
The canonical SMILES for 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine is NCc1nc2c(s1)COCC2.
What is the InChIKey of 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine?
The InChIKey is AWNQOWYGJYYQCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2OS/c8-3-7-9-5-1-2-10-4-6(5)11-7/h1-4,8H2.
What are the key properties of 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine?
6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine has a molecular weight of 170.24 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-ylmethanamine is sourced from PubChem (CID 43608929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).