2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide

C18H17N7O3 — CID 69158799

IUPAC2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide
SMILESCN(C)C(=O)COc1ccc(-n2c(-c3nonc3N)nc3cnccc32)cc1
InChIInChI=1S/C18H17N7O3/c1-24(2)15(26)10-27-12-5-3-11(4-6-12)25-14-7-8-20-9-13(14)21-18(25)16-17(19)23-28-22-16/h3-9H,10H2,1-2H3,(H2,19,23)
InChIKeyDOQRQSRMKLCNSX-UHFFFAOYSA-N
MW379.38 g/mol
LogP1.52
Rot. Bonds5

About 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide

2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide (PubChem CID 69158799) has the molecular formula C18H17N7O3 and a molecular weight of 379.38 g/mol. Its IUPAC name is 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide
PubChem CID69158799
Molecular FormulaC18H17N7O3
Molecular Weight379.38 g/mol
Exact Mass379.14
IUPAC Name2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide
SMILESCN(C)C(=O)COc1ccc(-n2c(-c3nonc3N)nc3cnccc32)cc1
InChIInChI=1S/C18H17N7O3/c1-24(2)15(26)10-27-12-5-3-11(4-6-12)25-14-7-8-20-9-13(14)21-18(25)16-17(19)23-28-22-16/h3-9H,10H2,1-2H3,(H2,19,23)
InChIKeyDOQRQSRMKLCNSX-UHFFFAOYSA-N
XLogP1.52
TPSA125.19 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.38
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]ethyl-methylamino]acetic acid
CID 11350364
4-[1-[4-(3-methylbutoxy)phenyl]imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine
CID 59681820
4-[1-[4-[2-(methylsulfonylmethylamino)ethoxy]phenyl]imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine
CID 11258931
4-[1-[4-(2-bromoethoxy)phenyl]imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine;2,2,2-trifluoroacetic acid
CID 69198907
4-[1-[4-(pyrrolidin-2-ylmethoxy)phenyl]imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine
CID 69158204
(NE)-N-[1-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenyl]ethylidene]hydroxylamine
CID 87717556
N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-[4-[2-(dimethylamino)ethoxy]phenyl]imidazo[4,5-c]pyridin-6-yl]oxyphenyl]-6-methylpyridine-3-carboxamide
CID 68873579
4-[2-(4-amino-1,2,5-oxadiazol-3-yl)-6-(3-aminophenoxy)imidazo[4,5-c]pyridin-1-yl]phenol
CID 68873899
3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-phenylimidazo[4,5-c]pyridin-6-yl]oxy-N-(2-methoxyethyl)benzamide
CID 11454226
3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-phenylimidazo[4,5-c]pyridin-6-yl]oxy-N-(cyclopropylmethyl)benzamide
CID 68873444
[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenyl]methyl acetate
CID 70185760
methyl 3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-(1H-indazol-5-yl)imidazo[4,5-c]pyridin-6-yl]oxybenzoate
CID 68875483

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide?
The IUPAC name of 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide (CID 69158799) is 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide?
The canonical SMILES for 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide is CN(C)C(=O)COc1ccc(-n2c(-c3nonc3N)nc3cnccc32)cc1.
What is the InChIKey of 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide?
The InChIKey is DOQRQSRMKLCNSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N7O3/c1-24(2)15(26)10-27-12-5-3-11(4-6-12)25-14-7-8-20-9-13(14)21-18(25)16-17(19)23-28-22-16/h3-9H,10H2,1-2H3,(H2,19,23).
What are the key properties of 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide?
2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide has a molecular weight of 379.38 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(4-amino-1,2,5-oxadiazol-3-yl)imidazo[4,5-c]pyridin-1-yl]phenoxy]-N,N-dimethylacetamide is sourced from PubChem (CID 69158799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).