5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine

C13H15ClN4O — CID 171660385

IUPAC5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine
SMILESNc1cc(-c2cnc(C3CCNCC3)o2)c(Cl)cn1
InChIInChI=1S/C13H15ClN4O/c14-10-6-17-12(15)5-9(10)11-7-18-13(19-11)8-1-3-16-4-2-8/h5-8,16H,1-4H2,(H2,15,17)
InChIKeyMKSMNLSUGANQTO-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.44
Rot. Bonds2

About 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine

5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine (PubChem CID 171660385) has the molecular formula C13H15ClN4O and a molecular weight of 278.74 g/mol. Its IUPAC name is 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine
PubChem CID171660385
Molecular FormulaC13H15ClN4O
Molecular Weight278.74 g/mol
Exact Mass278.09
IUPAC Name5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine
SMILESNc1cc(-c2cnc(C3CCNCC3)o2)c(Cl)cn1
InChIInChI=1S/C13H15ClN4O/c14-10-6-17-12(15)5-9(10)11-7-18-13(19-11)8-1-3-16-4-2-8/h5-8,16H,1-4H2,(H2,15,17)
InChIKeyMKSMNLSUGANQTO-UHFFFAOYSA-N
XLogP2.44
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine?
The IUPAC name of 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine (CID 171660385) is 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine?
The canonical SMILES for 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine is Nc1cc(-c2cnc(C3CCNCC3)o2)c(Cl)cn1.
What is the InChIKey of 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine?
The InChIKey is MKSMNLSUGANQTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN4O/c14-10-6-17-12(15)5-9(10)11-7-18-13(19-11)8-1-3-16-4-2-8/h5-8,16H,1-4H2,(H2,15,17).
What are the key properties of 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine?
5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine has a molecular weight of 278.74 g/mol, XLogP of 2.44, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(2-piperidin-4-yl-1,3-oxazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 171660385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).