3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

C18H17N7O3 — CID 134813269

IUPAC3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
SMILESCCc1noc2ncc(C(=O)Nc3ccc(OC)c(-n4nnnc4C)c3)cc12
InChIInChI=1S/C18H17N7O3/c1-4-14-13-7-11(9-19-18(13)28-22-14)17(26)20-12-5-6-16(27-3)15(8-12)25-10(2)21-23-24-25/h5-9H,4H2,1-3H3,(H,20,26)
InChIKeyVPKNVDQKDIAZDA-UHFFFAOYSA-N
MW379.38 g/mol
LogP2.33
Rot. Bonds5

About 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide (PubChem CID 134813269) has the molecular formula C18H17N7O3 and a molecular weight of 379.38 g/mol. Its IUPAC name is 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
PubChem CID134813269
Molecular FormulaC18H17N7O3
Molecular Weight379.38 g/mol
Exact Mass379.14
IUPAC Name3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
SMILESCCc1noc2ncc(C(=O)Nc3ccc(OC)c(-n4nnnc4C)c3)cc12
InChIInChI=1S/C18H17N7O3/c1-4-14-13-7-11(9-19-18(13)28-22-14)17(26)20-12-5-6-16(27-3)15(8-12)25-10(2)21-23-24-25/h5-9H,4H2,1-3H3,(H,20,26)
InChIKeyVPKNVDQKDIAZDA-UHFFFAOYSA-N
XLogP2.33
TPSA120.85 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 ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-6-phenylpyridazine-4-carboxamide
CID 167800736
1-[(2R)-butan-2-yl]-3-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-1-methylurea
CID 95317921
tert-butyl 7-[(3-ethyl-[1,2]oxazolo[5,4-b]pyridine-5-carbonyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylate
CID 86934725
N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 167747098
(2S)-2-amino-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]propanamide
CID 119313707
2-[(3-bromobenzoyl)amino]-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]benzamide
CID 167957621
3-ethyl-N-[3-(ethylaminomethyl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 119438001
N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-2-thiophen-2-ylacetamide
CID 52866977
N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-1-(4-methylphenyl)triazole-4-carboxamide
CID 134813277
N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-3-pyridin-2-ylpropanamide
CID 134813273
(3S)-1-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 95295849
4-bromo-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 56586278

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The IUPAC name of 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide (CID 134813269) is 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide.
What is the SMILES notation for 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The canonical SMILES for 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide is CCc1noc2ncc(C(=O)Nc3ccc(OC)c(-n4nnnc4C)c3)cc12.
What is the InChIKey of 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The InChIKey is VPKNVDQKDIAZDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N7O3/c1-4-14-13-7-11(9-19-18(13)28-22-14)17(26)20-12-5-6-16(27-3)15(8-12)25-10(2)21-23-24-25/h5-9H,4H2,1-3H3,(H,20,26).
What are the key properties of 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide has a molecular weight of 379.38 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 134813269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).