N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide

C19H20FNO3 — CID 97432010

IUPACN-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide
SMILESC/C=C\c1cc(C(=O)Nc2ccc(F)cc2C)cc(OC)c1OC
InChIInChI=1S/C19H20FNO3/c1-5-6-13-10-14(11-17(23-3)18(13)24-4)19(22)21-16-8-7-15(20)9-12(16)2/h5-11H,1-4H3,(H,21,22)/b6-5-
InChIKeyDHKCUEKDFNIARJ-WAYWQWQTSA-N
MW329.37 g/mol
LogP4.44
Rot. Bonds5

About N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide

N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide (PubChem CID 97432010) has the molecular formula C19H20FNO3 and a molecular weight of 329.37 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide
PubChem CID97432010
Molecular FormulaC19H20FNO3
Molecular Weight329.37 g/mol
Exact Mass329.14
IUPAC NameN-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide
SMILESC/C=C\c1cc(C(=O)Nc2ccc(F)cc2C)cc(OC)c1OC
InChIInChI=1S/C19H20FNO3/c1-5-6-13-10-14(11-17(23-3)18(13)24-4)19(22)21-16-8-7-15(20)9-12(16)2/h5-11H,1-4H3,(H,21,22)/b6-5-
InChIKeyDHKCUEKDFNIARJ-WAYWQWQTSA-N
XLogP4.44
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.37
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(E)-prop-1-enyl]benzamide
CID 24529374
3-chloro-4-ethoxy-N-(4-fluoro-2-methylphenyl)-5-methoxybenzamide
CID 26239702
4-amino-N-(4-fluoro-2-methylphenyl)-3-methoxybenzamide
CID 104782299
N-(4-fluoro-2-methylphenyl)-3,5-dihydroxybenzamide
CID 103891547
3,4-dimethoxy-5-[(E)-prop-1-enyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 18105718
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3,4-dimethoxy-5-[(E)-prop-1-enyl]benzamide
CID 24532422
4-bromo-N-(4-fluoro-2-methoxyphenyl)-3,5-dimethoxybenzamide
CID 32610623
3,4-dimethoxy-5-[(E)-prop-1-enyl]-N-prop-2-enylbenzamide
CID 17456116
N-(4-fluoro-2-methylphenyl)-3-methylbenzamide
CID 2550656
4-bromo-N-(2,4-difluorophenyl)-3,5-dimethoxybenzamide
CID 26586057
N-(4-fluoro-2-methylphenyl)-4-iodobenzamide
CID 7980558
4-[(4-fluoro-2-methylbenzoyl)amino]-3-methoxybenzoic acid
CID 137374056

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide (CID 97432010) is N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide is C/C=C\c1cc(C(=O)Nc2ccc(F)cc2C)cc(OC)c1OC.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide?
The InChIKey is DHKCUEKDFNIARJ-WAYWQWQTSA-N. The full InChI is InChI=1S/C19H20FNO3/c1-5-6-13-10-14(11-17(23-3)18(13)24-4)19(22)21-16-8-7-15(20)9-12(16)2/h5-11H,1-4H3,(H,21,22)/b6-5-.
What are the key properties of N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide?
N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide has a molecular weight of 329.37 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methylphenyl)-3,4-dimethoxy-5-[(Z)-prop-1-enyl]benzamide is sourced from PubChem (CID 97432010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).