4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide

C17H15F2N5O3 — CID 41357494

IUPAC4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide
SMILESCOc1cc(C(=O)Nc2cccc(-c3nnnn3C)c2)ccc1OC(F)F
InChIInChI=1S/C17H15F2N5O3/c1-24-15(21-22-23-24)10-4-3-5-12(8-10)20-16(25)11-6-7-13(27-17(18)19)14(9-11)26-2/h3-9,17H,1-2H3,(H,20,25)
InChIKeyZROQHOKMDGWXMN-UHFFFAOYSA-N
MW375.34 g/mol
LogP2.74
Rot. Bonds6

About 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide

4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide (PubChem CID 41357494) has the molecular formula C17H15F2N5O3 and a molecular weight of 375.34 g/mol. Its IUPAC name is 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide
PubChem CID41357494
Molecular FormulaC17H15F2N5O3
Molecular Weight375.34 g/mol
Exact Mass375.11
IUPAC Name4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide
SMILESCOc1cc(C(=O)Nc2cccc(-c3nnnn3C)c2)ccc1OC(F)F
InChIInChI=1S/C17H15F2N5O3/c1-24-15(21-22-23-24)10-4-3-5-12(8-10)20-16(25)11-6-7-13(27-17(18)19)14(9-11)26-2/h3-9,17H,1-2H3,(H,20,25)
InChIKeyZROQHOKMDGWXMN-UHFFFAOYSA-N
XLogP2.74
TPSA91.16 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.34
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide
CID 2171846
3-chloro-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide
CID 30414116
3,4-dimethoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]-5-prop-2-enylbenzamide
CID 41360681
4-(difluoromethoxy)-3-methoxy-N-pyridin-4-ylbenzamide
CID 3461577
(E)-3-[2,4-bis(difluoromethoxy)phenyl]-N-[3-(1-methyltetrazol-5-yl)phenyl]prop-2-enamide
CID 41359971
N-(3-bromophenyl)-3-(difluoromethoxy)-4-methoxybenzamide
CID 46482952
4-methoxy-N-[3-methyl-1-[3-(1-methyltetrazol-5-yl)anilino]-1-oxobutan-2-yl]benzamide
CID 46700138
5,6-dichloro-N-[3-(1-methyltetrazol-5-yl)phenyl]pyridine-3-carboxamide
CID 51304309
methyl 2-[[3-[[4-(difluoromethoxy)-3-methoxybenzoyl]amino]benzoyl]amino]acetate
CID 55727946
N-[2-methoxy-4-[[3-(1-methyltetrazol-5-yl)phenyl]carbamoylamino]phenyl]acetamide
CID 48782752
N-[4-(difluoromethoxy)-3-methoxyphenyl]-4-methylbenzamide
CID 4865288
2-bromo-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide
CID 17422742

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide?
The IUPAC name of 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide (CID 41357494) is 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide.
What is the SMILES notation for 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide?
The canonical SMILES for 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide is COc1cc(C(=O)Nc2cccc(-c3nnnn3C)c2)ccc1OC(F)F.
What is the InChIKey of 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide?
The InChIKey is ZROQHOKMDGWXMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2N5O3/c1-24-15(21-22-23-24)10-4-3-5-12(8-10)20-16(25)11-6-7-13(27-17(18)19)14(9-11)26-2/h3-9,17H,1-2H3,(H,20,25).
What are the key properties of 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide?
4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide has a molecular weight of 375.34 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethoxy)-3-methoxy-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide is sourced from PubChem (CID 41357494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).