(1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine

C20H27N5O2 — CID 129338503

IUPAC(1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine
SMILESCc1ccc2ncc(CN[C@@H](c3nc(C(C)C)no3)C3CCOCC3)n2c1
InChIInChI=1S/C20H27N5O2/c1-13(2)19-23-20(27-24-19)18(15-6-8-26-9-7-15)22-11-16-10-21-17-5-4-14(3)12-25(16)17/h4-5,10,12-13,15,18,22H,6-9,11H2,1-3H3/t18-/m1/s1
InChIKeyUORMIGSWUPFMNT-GOSISDBHSA-N
MW369.47 g/mol
LogP3.41
Rot. Bonds6

About (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine

(1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine (PubChem CID 129338503) has the molecular formula C20H27N5O2 and a molecular weight of 369.47 g/mol. Its IUPAC name is (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine.

Molecular Properties

Compound Name(1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine
PubChem CID129338503
Molecular FormulaC20H27N5O2
Molecular Weight369.47 g/mol
Exact Mass369.22
IUPAC Name(1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine
SMILESCc1ccc2ncc(CN[C@@H](c3nc(C(C)C)no3)C3CCOCC3)n2c1
InChIInChI=1S/C20H27N5O2/c1-13(2)19-23-20(27-24-19)18(15-6-8-26-9-7-15)22-11-16-10-21-17-5-4-14(3)12-25(16)17/h4-5,10,12-13,15,18,22H,6-9,11H2,1-3H3/t18-/m1/s1
InChIKeyUORMIGSWUPFMNT-GOSISDBHSA-N
XLogP3.41
TPSA77.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine?
The IUPAC name of (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine (CID 129338503) is (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine.
What is the SMILES notation for (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine?
The canonical SMILES for (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine is Cc1ccc2ncc(CN[C@@H](c3nc(C(C)C)no3)C3CCOCC3)n2c1.
What is the InChIKey of (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine?
The InChIKey is UORMIGSWUPFMNT-GOSISDBHSA-N. The full InChI is InChI=1S/C20H27N5O2/c1-13(2)19-23-20(27-24-19)18(15-6-8-26-9-7-15)22-11-16-10-21-17-5-4-14(3)12-25(16)17/h4-5,10,12-13,15,18,22H,6-9,11H2,1-3H3/t18-/m1/s1.
What are the key properties of (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine?
(1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine has a molecular weight of 369.47 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine is sourced from PubChem (CID 129338503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).