N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine

C9H14FN3S — CID 175997625

IUPACN-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine
SMILESFCCCN1CC(Nc2nccs2)C1
InChIInChI=1S/C9H14FN3S/c10-2-1-4-13-6-8(7-13)12-9-11-3-5-14-9/h3,5,8H,1-2,4,6-7H2,(H,11,12)
InChIKeyDIDNELWKNUJFIE-UHFFFAOYSA-N
MW215.30 g/mol
LogP1.60
Rot. Bonds5

About N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine

N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine (PubChem CID 175997625) has the molecular formula C9H14FN3S and a molecular weight of 215.30 g/mol. Its IUPAC name is N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine
PubChem CID175997625
Molecular FormulaC9H14FN3S
Molecular Weight215.30 g/mol
Exact Mass215.09
IUPAC NameN-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine
SMILESFCCCN1CC(Nc2nccs2)C1
InChIInChI=1S/C9H14FN3S/c10-2-1-4-13-6-8(7-13)12-9-11-3-5-14-9/h3,5,8H,1-2,4,6-7H2,(H,11,12)
InChIKeyDIDNELWKNUJFIE-UHFFFAOYSA-N
XLogP1.60
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine?
The IUPAC name of N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine (CID 175997625) is N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine?
The canonical SMILES for N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine is FCCCN1CC(Nc2nccs2)C1.
What is the InChIKey of N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine?
The InChIKey is DIDNELWKNUJFIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FN3S/c10-2-1-4-13-6-8(7-13)12-9-11-3-5-14-9/h3,5,8H,1-2,4,6-7H2,(H,11,12).
What are the key properties of N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine?
N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine has a molecular weight of 215.30 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-fluoropropyl)azetidin-3-yl]-1,3-thiazol-2-amine is sourced from PubChem (CID 175997625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).