1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine

C11H15N3S2 — CID 82381741

IUPAC1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine
SMILESCN1CCC(N)CC1c1cc2cnsc2s1
InChIInChI=1S/C11H15N3S2/c1-14-3-2-8(12)5-9(14)10-4-7-6-13-16-11(7)15-10/h4,6,8-9H,2-3,5,12H2,1H3
InChIKeyNAGRXRZWRCKOOC-UHFFFAOYSA-N
MW253.40 g/mol
LogP2.45
Rot. Bonds1

About 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine

1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine (PubChem CID 82381741) has the molecular formula C11H15N3S2 and a molecular weight of 253.40 g/mol. Its IUPAC name is 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine.

Molecular Properties

Compound Name1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine
PubChem CID82381741
Molecular FormulaC11H15N3S2
Molecular Weight253.40 g/mol
Exact Mass253.07
IUPAC Name1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine
SMILESCN1CCC(N)CC1c1cc2cnsc2s1
InChIInChI=1S/C11H15N3S2/c1-14-3-2-8(12)5-9(14)10-4-7-6-13-16-11(7)15-10/h4,6,8-9H,2-3,5,12H2,1H3
InChIKeyNAGRXRZWRCKOOC-UHFFFAOYSA-N
XLogP2.45
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.40
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine?
The IUPAC name of 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine (CID 82381741) is 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine.
What is the SMILES notation for 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine?
The canonical SMILES for 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine is CN1CCC(N)CC1c1cc2cnsc2s1.
What is the InChIKey of 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine?
The InChIKey is NAGRXRZWRCKOOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S2/c1-14-3-2-8(12)5-9(14)10-4-7-6-13-16-11(7)15-10/h4,6,8-9H,2-3,5,12H2,1H3.
What are the key properties of 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine?
1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine has a molecular weight of 253.40 g/mol, XLogP of 2.45, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-thieno[3,2-d][1,2]thiazol-5-ylpiperidin-4-amine is sourced from PubChem (CID 82381741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).