5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine

C12H21N3S — CID 62943100

IUPAC5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESCCCNc1nc2c(s1)CN(C(C)C)CC2
InChIInChI=1S/C12H21N3S/c1-4-6-13-12-14-10-5-7-15(9(2)3)8-11(10)16-12/h9H,4-8H2,1-3H3,(H,13,14)
InChIKeyHYNTZLHCZSTDMH-UHFFFAOYSA-N
MW239.39 g/mol
LogP2.73
Rot. Bonds4

About 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine

5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine (PubChem CID 62943100) has the molecular formula C12H21N3S and a molecular weight of 239.39 g/mol. Its IUPAC name is 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine.

Molecular Properties

Compound Name5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
PubChem CID62943100
Molecular FormulaC12H21N3S
Molecular Weight239.39 g/mol
Exact Mass239.15
IUPAC Name5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESCCCNc1nc2c(s1)CN(C(C)C)CC2
InChIInChI=1S/C12H21N3S/c1-4-6-13-12-14-10-5-7-15(9(2)3)8-11(10)16-12/h9H,4-8H2,1-3H3,(H,13,14)
InChIKeyHYNTZLHCZSTDMH-UHFFFAOYSA-N
XLogP2.73
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.39
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The IUPAC name of 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine (CID 62943100) is 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine.
What is the SMILES notation for 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The canonical SMILES for 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine is CCCNc1nc2c(s1)CN(C(C)C)CC2.
What is the InChIKey of 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The InChIKey is HYNTZLHCZSTDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3S/c1-4-6-13-12-14-10-5-7-15(9(2)3)8-11(10)16-12/h9H,4-8H2,1-3H3,(H,13,14).
What are the key properties of 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine has a molecular weight of 239.39 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-N-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine is sourced from PubChem (CID 62943100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).