N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide

C18H19NO2 — CID 46566275

IUPACN-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide
SMILESCOc1ccc(C(NC(=O)c2ccccc2)C2CC2)cc1
InChIInChI=1S/C18H19NO2/c1-21-16-11-9-14(10-12-16)17(13-7-8-13)19-18(20)15-5-3-2-4-6-15/h2-6,9-13,17H,7-8H2,1H3,(H,19,20)
InChIKeyZOLJAJDTBFXHGY-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.58
Rot. Bonds5

About N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide

N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide (PubChem CID 46566275) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide.

Molecular Properties

Compound NameN-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide
PubChem CID46566275
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC NameN-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide
SMILESCOc1ccc(C(NC(=O)c2ccccc2)C2CC2)cc1
InChIInChI=1S/C18H19NO2/c1-21-16-11-9-14(10-12-16)17(13-7-8-13)19-18(20)15-5-3-2-4-6-15/h2-6,9-13,17H,7-8H2,1H3,(H,19,20)
InChIKeyZOLJAJDTBFXHGY-UHFFFAOYSA-N
XLogP3.58
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(R)-cyclopentyl(phenyl)methyl]-4-methoxybenzamide
CID 978301
4-[4-[[cyclopropyl-(4-methoxyphenyl)methyl]carbamoyl]phenoxy]benzamide
CID 56545772
N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide
CID 17494418
N-[cyclopropyl-(4-methoxyphenyl)methyl]acetamide
CID 60701170
N-[cyclopropyl-(4-methoxyphenyl)methyl]-3,4-difluorobenzamide
CID 46571976
N-[cyclopropyl-(4-methoxyphenyl)methyl]-3-(methanesulfonamido)benzamide
CID 55470366
N-[2-[[cyclopropyl-(4-methoxyphenyl)methyl]amino]-2-oxoethyl]-4-methoxybenzamide
CID 55461380
N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-oxidopyridin-1-ium-2-carboxamide
CID 75363643
N-[(R)-cyclopropyl-(4-methoxyphenyl)methyl]-4-morpholin-4-ylbenzamide
CID 92627391
N-[cyclopropyl-(4-methoxyphenyl)methyl]-2-methylpropanamide
CID 60701189
N-[cyclopropyl(phenyl)methyl]-2-(4-methoxyphenoxy)propanamide
CID 46509264
4-[4-[[cyclopropyl(phenyl)methyl]carbamoyl]phenoxy]benzamide
CID 56545703

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide?
The IUPAC name of N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide (CID 46566275) is N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide.
What is the SMILES notation for N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide?
The canonical SMILES for N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide is COc1ccc(C(NC(=O)c2ccccc2)C2CC2)cc1.
What is the InChIKey of N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide?
The InChIKey is ZOLJAJDTBFXHGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-21-16-11-9-14(10-12-16)17(13-7-8-13)19-18(20)15-5-3-2-4-6-15/h2-6,9-13,17H,7-8H2,1H3,(H,19,20).
What are the key properties of N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide?
N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide has a molecular weight of 281.36 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide is sourced from PubChem (CID 46566275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).