6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

C22H25N3O2 — CID 30212940

IUPAC6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCCCN(Cc1ccc(C)cc1)C(=O)c1cc(C2CC2)nc2onc(C)c12
InChIInChI=1S/C22H25N3O2/c1-4-11-25(13-16-7-5-14(2)6-8-16)22(26)18-12-19(17-9-10-17)23-21-20(18)15(3)24-27-21/h5-8,12,17H,4,9-11,13H2,1-3H3
InChIKeyFRARRQBSXOGCGW-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.77
Rot. Bonds6

About 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 30212940) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
PubChem CID30212940
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC Name6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCCCN(Cc1ccc(C)cc1)C(=O)c1cc(C2CC2)nc2onc(C)c12
InChIInChI=1S/C22H25N3O2/c1-4-11-25(13-16-7-5-14(2)6-8-16)22(26)18-12-19(17-9-10-17)23-21-20(18)15(3)24-27-21/h5-8,12,17H,4,9-11,13H2,1-3H3
InChIKeyFRARRQBSXOGCGW-UHFFFAOYSA-N
XLogP4.77
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-cyclopropyl-N-(2-hydroxyethyl)-3-methyl-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 110887145
6-cyclopropyl-N-ethyl-3-methyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 44821919
6-cyclopropyl-N-[(2,4-dimethylphenyl)methyl]-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 32895796
[2-[benzyl(ethyl)amino]-2-oxoethyl] 6-cyclopropyl-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate
CID 18132933
6-cyclopropyl-N-ethyl-3-methyl-N-[[(2S)-oxolan-2-yl]methyl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 94822825
6-cyclopropyl-N-[1-(4-methoxyphenyl)propan-2-yl]-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 51130319
N-benzyl-6-cyclopropyl-1,3-dimethyl-N-propylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 31741626
6-cyclopropyl-N,3-dimethyl-N-(4-methylcyclohexyl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 32918771
N-(3-amino-2,2-dimethylpropyl)-6-cyclopropyl-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 119656768
N-(cyclopropylmethyl)-6-(furan-2-yl)-3-methyl-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 51322778
2-[butan-2-yl-(6-cyclopropyl-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carbonyl)amino]acetic acid
CID 119954747
6-cyclopropyl-N-[[4-(ethylcarbamoyl)phenyl]methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 86990003

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (CID 30212940) is 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is CCCN(Cc1ccc(C)cc1)C(=O)c1cc(C2CC2)nc2onc(C)c12.
What is the InChIKey of 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is FRARRQBSXOGCGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-4-11-25(13-16-7-5-14(2)6-8-16)22(26)18-12-19(17-9-10-17)23-21-20(18)15(3)24-27-21/h5-8,12,17H,4,9-11,13H2,1-3H3.
What are the key properties of 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 363.46 g/mol, XLogP of 4.77, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-methyl-N-[(4-methylphenyl)methyl]-N-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 30212940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).