N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine

C15H17N3O2 — CID 69188195

IUPACN-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine
SMILESCOc1ccc(NC2=CN(C)Cc3onc(C)c32)cc1
InChIInChI=1S/C15H17N3O2/c1-10-15-13(8-18(2)9-14(15)20-17-10)16-11-4-6-12(19-3)7-5-11/h4-8,16H,9H2,1-3H3
InChIKeyLITWCXBHORLFAK-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.85
Rot. Bonds3

About N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine

N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine (PubChem CID 69188195) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine
PubChem CID69188195
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine
SMILESCOc1ccc(NC2=CN(C)Cc3onc(C)c32)cc1
InChIInChI=1S/C15H17N3O2/c1-10-15-13(8-18(2)9-14(15)20-17-10)16-11-4-6-12(19-3)7-5-11/h4-8,16H,9H2,1-3H3
InChIKeyLITWCXBHORLFAK-UHFFFAOYSA-N
XLogP2.85
TPSA50.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-(4-methoxyanilino)benzonitrile
CID 126602162
N-(4-methoxyphenyl)-2-methylpyrimidin-4-amine
CID 91342021
3-buta-1,3-dienyl-5-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]-N-(4-methoxyphenyl)imidazol-4-amine
CID 123788680
ethyl 5-(4-methoxyanilino)-3-methyl-1,2-oxazole-4-carboxylate
CID 44522768
3-N,7-N,11-N-tris(4-methoxyphenyl)-2,4,6,8,10,12,13-heptazatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaene-3,7,11-triamine
CID 15982464
5-methoxy-N-(4-methoxyphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
CID 1385785
2-N-(4-methoxyphenyl)-4-N-(4-methylphenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine;hydrochloride
CID 18580364
4,6-dichloro-N-(4-methoxyphenyl)pyrimidin-2-amine
CID 10849619
5-(4-methoxyanilino)-1,1,2-trimethyl-4-trimethylsilylpyrazol-1-ium-3-thione
CID 102119592
N-(4-methoxyphenyl)-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 28866754
2-cyclopropyl-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine
CID 53301186
4-N-cycloheptyl-2-N-(4-methoxyphenyl)pyrimidine-2,4-diamine
CID 112899904

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine?
The IUPAC name of N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine (CID 69188195) is N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine?
The canonical SMILES for N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine is COc1ccc(NC2=CN(C)Cc3onc(C)c32)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine?
The InChIKey is LITWCXBHORLFAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-15-13(8-18(2)9-14(15)20-17-10)16-11-4-6-12(19-3)7-5-11/h4-8,16H,9H2,1-3H3.
What are the key properties of N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine?
N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine has a molecular weight of 271.32 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-3,6-dimethyl-7H-[1,2]oxazolo[5,4-c]pyridin-4-amine is sourced from PubChem (CID 69188195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).