2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide

C14H18N2O4 — CID 75415358

IUPAC2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide
SMILESCN(C(=O)COC1CCCC1)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C14H18N2O4/c1-15(11-6-8-12(9-7-11)16(18)19)14(17)10-20-13-4-2-3-5-13/h6-9,13H,2-5,10H2,1H3
InChIKeyWVJFQMWJQPAEKE-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.52
Rot. Bonds5

About 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide

2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide (PubChem CID 75415358) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide.

Molecular Properties

Compound Name2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide
PubChem CID75415358
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide
SMILESCN(C(=O)COC1CCCC1)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C14H18N2O4/c1-15(11-6-8-12(9-7-11)16(18)19)14(17)10-20-13-4-2-3-5-13/h6-9,13H,2-5,10H2,1H3
InChIKeyWVJFQMWJQPAEKE-UHFFFAOYSA-N
XLogP2.52
TPSA72.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[cyclopropyl(2-hydroxyethyl)amino]-N-methyl-N-(4-nitrophenyl)acetamide
CID 110899426
N-methyl-N-(4-nitrophenyl)-3-piperidin-2-ylpropanamide
CID 62210857
N-methyl-N-(4-nitrophenyl)octanamide
CID 71368131
(2S)-1-[2-(N-methyl-4-nitroanilino)-2-oxoethyl]pyrrolidine-2-carboxylic acid
CID 119910568
2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-(4-nitrophenyl)acetamide
CID 24602409
4-[methyl-(2-piperidin-4-yloxyacetyl)amino]benzoic acid
CID 104698715
5-chloro-N-methyl-N-(4-nitrophenyl)pentanamide
CID 28971596
2-amino-N-methyl-N-(4-nitrophenyl)cyclopentane-1-carboxamide
CID 64822129
ethyl 4-[2-(N-methyl-4-nitroanilino)-2-oxoethoxy]benzoate
CID 42156725
5-bromo-N-methyl-N-(4-nitrophenyl)pentanamide
CID 107907357
2-cyclohexyloxy-N,N-dimethylacetamide
CID 89427272
2-[methyl-[4-(4-nitrophenyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid
CID 66738210

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide?
The IUPAC name of 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide (CID 75415358) is 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide.
What is the SMILES notation for 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide?
The canonical SMILES for 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide is CN(C(=O)COC1CCCC1)c1ccc([N+](=O)[O-])cc1.
What is the InChIKey of 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide?
The InChIKey is WVJFQMWJQPAEKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-15(11-6-8-12(9-7-11)16(18)19)14(17)10-20-13-4-2-3-5-13/h6-9,13H,2-5,10H2,1H3.
What are the key properties of 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide?
2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide has a molecular weight of 278.31 g/mol, XLogP of 2.52, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-N-methyl-N-(4-nitrophenyl)acetamide is sourced from PubChem (CID 75415358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).