N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide

C15H20N2O2 — CID 921109

IUPACN-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide
SMILESCc1ccc(C)c(OCC(=O)NN=C2CCCC2)c1
InChIInChI=1S/C15H20N2O2/c1-11-7-8-12(2)14(9-11)19-10-15(18)17-16-13-5-3-4-6-13/h7-9H,3-6,10H2,1-2H3,(H,17,18)
InChIKeyZEFULAWDBCHWJT-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.73
Rot. Bonds4

About N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide

N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide (PubChem CID 921109) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide
PubChem CID921109
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide
SMILESCc1ccc(C)c(OCC(=O)NN=C2CCCC2)c1
InChIInChI=1S/C15H20N2O2/c1-11-7-8-12(2)14(9-11)19-10-15(18)17-16-13-5-3-4-6-13/h7-9H,3-6,10H2,1-2H3,(H,17,18)
InChIKeyZEFULAWDBCHWJT-UHFFFAOYSA-N
XLogP2.73
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.73
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-[(E)-(3,3-dimethyl-5-oxocyclohexylidene)amino]-2-(2,5-dimethylphenoxy)acetamide
CID 5419588
N-(cyclooctylideneamino)-2-(4-methylphenoxy)acetamide
CID 54786886
2-(2,5-dimethylphenoxy)-N-[(2-ethylcyclopentylidene)amino]acetamide
CID 3307043
N-(cycloheptylideneamino)-2-(3,5-dimethylphenoxy)acetamide
CID 3379607
N-(cyclohexylideneamino)-2-(2,4,5-trichlorophenoxy)acetamide
CID 5062453
N-[(Z)-[(1S,5S)-6-bicyclo[3.2.0]hept-2-enylidene]amino]-2-(2,5-dimethylphenoxy)acetamide
CID 9316048
N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide
CID 4113350
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-methoxyacetohydrazide
CID 47102429
N'-(2-chloroacetyl)-2-(2,5-dimethylphenoxy)acetohydrazide
CID 166414788
N-(cyclooctylideneamino)-2-(2,4-dimethylanilino)acetamide
CID 54786974
2-(2,5-dimethylphenoxy)-N-(1-phenylethylideneamino)acetamide
CID 958391
N-(cyclododecylideneamino)-2-(2-propan-2-ylphenoxy)acetamide
CID 54785656

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide?
The IUPAC name of N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide (CID 921109) is N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide?
The canonical SMILES for N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide is Cc1ccc(C)c(OCC(=O)NN=C2CCCC2)c1.
What is the InChIKey of N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide?
The InChIKey is ZEFULAWDBCHWJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-11-7-8-12(2)14(9-11)19-10-15(18)17-16-13-5-3-4-6-13/h7-9H,3-6,10H2,1-2H3,(H,17,18).
What are the key properties of N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide?
N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide has a molecular weight of 260.34 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylideneamino)-2-(2,5-dimethylphenoxy)acetamide is sourced from PubChem (CID 921109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).