4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide

C19H20N6O3 — CID 50776826

IUPAC4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cc(-n3cnnn3)ccc2N2CCOCC2)cc1
InChIInChI=1S/C19H20N6O3/c1-27-16-5-2-14(3-6-16)19(26)21-17-12-15(25-13-20-22-23-25)4-7-18(17)24-8-10-28-11-9-24/h2-7,12-13H,8-11H2,1H3,(H,21,26)
InChIKeyAZXCWEVMFYMSDA-UHFFFAOYSA-N
MW380.41 g/mol
LogP1.76
Rot. Bonds5

About 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide

4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide (PubChem CID 50776826) has the molecular formula C19H20N6O3 and a molecular weight of 380.41 g/mol. Its IUPAC name is 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide
PubChem CID50776826
Molecular FormulaC19H20N6O3
Molecular Weight380.41 g/mol
Exact Mass380.16
IUPAC Name4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cc(-n3cnnn3)ccc2N2CCOCC2)cc1
InChIInChI=1S/C19H20N6O3/c1-27-16-5-2-14(3-6-16)19(26)21-17-12-15(25-13-20-22-23-25)4-7-18(17)24-8-10-28-11-9-24/h2-7,12-13H,8-11H2,1H3,(H,21,26)
InChIKeyAZXCWEVMFYMSDA-UHFFFAOYSA-N
XLogP1.76
TPSA94.40 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.41
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

4-methoxy-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)benzamide
CID 110400402
3,5-dimethoxy-N-[2-pyrrolidin-1-yl-5-(tetrazol-1-yl)phenyl]benzamide
CID 50776801
4-chloro-N-[2-pyrrolidin-1-yl-5-(tetrazol-1-yl)phenyl]benzamide
CID 50776956
4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide
CID 6473304
4-bromo-N-[2-piperidin-1-yl-5-(tetrazol-1-yl)phenyl]benzamide
CID 50777019
3-methyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-(tetrazol-1-yl)benzamide
CID 55616983
N-(2-fluoro-5-morpholin-4-ylphenyl)-4-methoxybenzamide
CID 110362600
N-(5-methoxy-2-morpholin-4-ylphenyl)-3,4-dimethylbenzamide
CID 17027218
4-methoxy-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)benzamide
CID 17174256
2-(3-methoxyphenyl)-N-[2-piperidin-1-yl-5-(tetrazol-1-yl)phenyl]acetamide
CID 50777039
N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 6473397
N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide
CID 4034494

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide (CID 50776826) is 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide is COc1ccc(C(=O)Nc2cc(-n3cnnn3)ccc2N2CCOCC2)cc1.
What is the InChIKey of 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide?
The InChIKey is AZXCWEVMFYMSDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O3/c1-27-16-5-2-14(3-6-16)19(26)21-17-12-15(25-13-20-22-23-25)4-7-18(17)24-8-10-28-11-9-24/h2-7,12-13H,8-11H2,1H3,(H,21,26).
What are the key properties of 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide?
4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide has a molecular weight of 380.41 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide is sourced from PubChem (CID 50776826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).