N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide

C19H20N2O2 — CID 4562068

IUPACN-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)NN=C1CCCC1
InChIInChI=1S/C19H20N2O2/c22-19(21-20-17-8-4-5-9-17)14-23-18-12-10-16(11-13-18)15-6-2-1-3-7-15/h1-3,6-7,10-13H,4-5,8-9,14H2,(H,21,22)
InChIKeyQRMFAFOZSUAPQS-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.78
Rot. Bonds5

About N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide

N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide (PubChem CID 4562068) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide
PubChem CID4562068
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)NN=C1CCCC1
InChIInChI=1S/C19H20N2O2/c22-19(21-20-17-8-4-5-9-17)14-23-18-12-10-16(11-13-18)15-6-2-1-3-7-15/h1-3,6-7,10-13H,4-5,8-9,14H2,(H,21,22)
InChIKeyQRMFAFOZSUAPQS-UHFFFAOYSA-N
XLogP3.78
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.78
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

N-(cyclohexylideneamino)-2-(4-phenylmethoxyphenoxy)acetamide
CID 29154497
N-(cyclooctylideneamino)-2-(4-methylphenoxy)acetamide
CID 54786886
N-[(3-methylcyclohexylidene)amino]-2-(4-phenylphenoxy)acetamide
CID 3270935
N-(cycloheptylideneamino)-2-(4-methoxyphenoxy)acetamide
CID 5091509
N-(cyclooctylideneamino)-2-naphthalen-2-yloxyacetamide
CID 4674505
2-(4-butoxyphenoxy)-N-(cyclohexylideneamino)acetamide
CID 4193527
2-(3-bromophenoxy)-N-(cyclododecylideneamino)acetamide
CID 4598925
propyl 4-[2-(2-cyclooctylidenehydrazinyl)-2-oxoethoxy]benzoate
CID 54786846
N-[(Z)-[(1S,5R)-6-bicyclo[3.2.0]hept-2-enylidene]amino]-2-(4-phenylphenoxy)acetamide
CID 9316703
N-(cycloheptylideneamino)-2-(3,5-dimethylphenoxy)acetamide
CID 3379607
N'-acetyl-2-(4-phenylphenoxy)acetohydrazide
CID 3274977
(2S)-N-(cyclohexylideneamino)-2-(4-phenylphenoxy)propanamide
CID 92640740

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide?
The IUPAC name of N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide (CID 4562068) is N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide.
What is the SMILES notation for N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide?
The canonical SMILES for N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide is O=C(COc1ccc(-c2ccccc2)cc1)NN=C1CCCC1.
What is the InChIKey of N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide?
The InChIKey is QRMFAFOZSUAPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c22-19(21-20-17-8-4-5-9-17)14-23-18-12-10-16(11-13-18)15-6-2-1-3-7-15/h1-3,6-7,10-13H,4-5,8-9,14H2,(H,21,22).
What are the key properties of N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide?
N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide has a molecular weight of 308.38 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylideneamino)-2-(4-phenylphenoxy)acetamide is sourced from PubChem (CID 4562068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).