N-pentyl-3-phenylmethoxybenzamide

C19H23NO2 — CID 112759707

IUPACN-pentyl-3-phenylmethoxybenzamide
SMILESCCCCCNC(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C19H23NO2/c1-2-3-7-13-20-19(21)17-11-8-12-18(14-17)22-15-16-9-5-4-6-10-16/h4-6,8-12,14H,2-3,7,13,15H2,1H3,(H,20,21)
InChIKeyJROGIWLQTDPQMF-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.19
Rot. Bonds8

About N-pentyl-3-phenylmethoxybenzamide

N-pentyl-3-phenylmethoxybenzamide (PubChem CID 112759707) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-pentyl-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-pentyl-3-phenylmethoxybenzamide
PubChem CID112759707
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-pentyl-3-phenylmethoxybenzamide
SMILESCCCCCNC(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C19H23NO2/c1-2-3-7-13-20-19(21)17-11-8-12-18(14-17)22-15-16-9-5-4-6-10-16/h4-6,8-12,14H,2-3,7,13,15H2,1H3,(H,20,21)
InChIKeyJROGIWLQTDPQMF-UHFFFAOYSA-N
XLogP4.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-hydroxybutyl)-3-phenylmethoxybenzamide
CID 111433563
N-(3-aminobutyl)-3-phenylmethoxybenzamide;hydrochloride
CID 119497996
3-methoxy-N-tridecylbenzamide
CID 139819898
3-(2-phenylethoxy)-N-[8-[[3-(2-phenylethoxy)benzoyl]amino]octyl]benzamide
CID 17233441
[3-(pentylcarbamoyl)phenyl] acetate
CID 89122347
3-(2-ethoxyethoxy)-N-hexadecylbenzamide
CID 17139521
3-propoxy-N-[3-[(3-propoxybenzoyl)amino]propyl]benzamide
CID 4960565
3-ethoxy-N-[3-[(3-ethoxybenzoyl)amino]propyl]benzamide
CID 4958099
3-[(4-propan-2-ylphenyl)methoxy]-N-propylbenzamide
CID 86031288
N-[(3-methylphenyl)methyl]-3-phenylmethoxybenzamide
CID 50875108
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-pentylbenzamide
CID 134009641
N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide
CID 120650597

Frequently Asked Questions

What is the IUPAC name of N-pentyl-3-phenylmethoxybenzamide?
The IUPAC name of N-pentyl-3-phenylmethoxybenzamide (CID 112759707) is N-pentyl-3-phenylmethoxybenzamide.
What is the SMILES notation for N-pentyl-3-phenylmethoxybenzamide?
The canonical SMILES for N-pentyl-3-phenylmethoxybenzamide is CCCCCNC(=O)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-pentyl-3-phenylmethoxybenzamide?
The InChIKey is JROGIWLQTDPQMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-2-3-7-13-20-19(21)17-11-8-12-18(14-17)22-15-16-9-5-4-6-10-16/h4-6,8-12,14H,2-3,7,13,15H2,1H3,(H,20,21).
What are the key properties of N-pentyl-3-phenylmethoxybenzamide?
N-pentyl-3-phenylmethoxybenzamide has a molecular weight of 297.40 g/mol, XLogP of 4.19, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentyl-3-phenylmethoxybenzamide is sourced from PubChem (CID 112759707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).