4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide

C20H22N2O2 — CID 842328

IUPAC4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide
SMILESCC(=NNC(=O)c1ccc(OC2CCCC2)cc1)c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-15(16-7-3-2-4-8-16)21-22-20(23)17-11-13-19(14-12-17)24-18-9-5-6-10-18/h2-4,7-8,11-14,18H,5-6,9-10H2,1H3,(H,22,23)
InChIKeyBMEJCCUXFKXLNR-UHFFFAOYSA-N
MW322.41 g/mol
LogP4.16
Rot. Bonds5

About 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide

4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide (PubChem CID 842328) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide
PubChem CID842328
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide
SMILESCC(=NNC(=O)c1ccc(OC2CCCC2)cc1)c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-15(16-7-3-2-4-8-16)21-22-20(23)17-11-13-19(14-12-17)24-18-9-5-6-10-18/h2-4,7-8,11-14,18H,5-6,9-10H2,1H3,(H,22,23)
InChIKeyBMEJCCUXFKXLNR-UHFFFAOYSA-N
XLogP4.16
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-cyclopentyloxy-N-[(Z)-1-(4-ethylphenyl)ethylideneamino]benzamide
CID 6002881
N-[(Z)-1-(4-phenoxyphenyl)ethylideneamino]benzamide
CID 5418111
N-[(E)-1-(5-bromothiophen-2-yl)ethylideneamino]-4-cyclopentyloxybenzamide
CID 5455250
N-[1-(4-ethoxyphenyl)ethylideneamino]benzamide
CID 912000
N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide
CID 9215513
N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-4-phenylbenzamide
CID 5496134
N-[(E)-1-phenylethylideneamino]-4-prop-2-enoxybenzamide
CID 6232405
4-benzamido-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide
CID 3289478
4-(2-methylpropoxy)-N-(1-phenylethylideneamino)benzamide
CID 4929975
1-N,4-N-bis[(Z)-1-(4-cyclohexylphenyl)ethylideneamino]benzene-1,4-dicarboxamide
CID 6256670
1-methyl-N-[(E)-1-phenylethylideneamino]pyridin-1-ium-4-carboxamide
CID 51056262
1-(7-cyclononyloxycyclodeca-1,3,5,7,9-pentaen-1-yl)ethanone
CID 91060627

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide?
The IUPAC name of 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide (CID 842328) is 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide.
What is the SMILES notation for 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide?
The canonical SMILES for 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide is CC(=NNC(=O)c1ccc(OC2CCCC2)cc1)c1ccccc1.
What is the InChIKey of 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide?
The InChIKey is BMEJCCUXFKXLNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-15(16-7-3-2-4-8-16)21-22-20(23)17-11-13-19(14-12-17)24-18-9-5-6-10-18/h2-4,7-8,11-14,18H,5-6,9-10H2,1H3,(H,22,23).
What are the key properties of 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide?
4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide has a molecular weight of 322.41 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-(1-phenylethylideneamino)benzamide is sourced from PubChem (CID 842328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).