(2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide

C16H22ClNO3 — CID 124826238

IUPAC(2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide
SMILESCCOCCO[C@H](C)C(=O)N[C@@H]1C[C@H]1c1ccccc1Cl
InChIInChI=1S/C16H22ClNO3/c1-3-20-8-9-21-11(2)16(19)18-15-10-13(15)12-6-4-5-7-14(12)17/h4-7,11,13,15H,3,8-10H2,1-2H3,(H,18,19)/t11-,13+,15-/m1/s1
InChIKeyJZJPTWVAZDTPCR-OSAQELSMSA-N
MW311.81 g/mol
LogP2.75
Rot. Bonds8

About (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide

(2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide (PubChem CID 124826238) has the molecular formula C16H22ClNO3 and a molecular weight of 311.81 g/mol. Its IUPAC name is (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide
PubChem CID124826238
Molecular FormulaC16H22ClNO3
Molecular Weight311.81 g/mol
Exact Mass311.13
IUPAC Name(2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide
SMILESCCOCCO[C@H](C)C(=O)N[C@@H]1C[C@H]1c1ccccc1Cl
InChIInChI=1S/C16H22ClNO3/c1-3-20-8-9-21-11(2)16(19)18-15-10-13(15)12-6-4-5-7-14(12)17/h4-7,11,13,15H,3,8-10H2,1-2H3,(H,18,19)/t11-,13+,15-/m1/s1
InChIKeyJZJPTWVAZDTPCR-OSAQELSMSA-N
XLogP2.75
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.81
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide 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

N-[(1S,2R)-2-(2-chlorophenyl)cyclopropyl]-4-methylpentanamide
CID 97014434
N-[2-(2-chlorophenyl)cyclopropyl]-2-methoxyacetamide
CID 90019460
N-[(1S,2R)-2-(2-chlorophenyl)cyclopropyl]-2-methoxyacetamide
CID 90020152
(2R)-2-(2-ethoxyethoxy)-N-[(5S)-2,3,4,5-tetrahydro-1-benzoxepin-5-yl]propanamide
CID 95282629
cis-(1S,3R)-3-[2-(2-ethoxyethoxy)propanoylamino]cyclopentane-1-carboxylic acid
CID 120675280
(2S)-N-cyclopropyl-2-[[(2S)-2-(2-ethoxyethoxy)propanoyl]amino]-3-phenylpropanamide
CID 95159522
N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(4-fluorophenyl)acetamide
CID 166359293
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-2-(2-ethoxyethoxy)-N-methylpropanamide
CID 55925375
cis-ethyl (1S,2R)-2-(2-chlorophenyl)cyclopropane-1-carboxylate
CID 86338840
N-(2-tert-butylphenyl)-2-(2-ethoxyethoxy)propanamide
CID 60546063
N-[2-(2-chlorophenyl)cyclopropyl]-2-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 71880321
(2S)-2-(2-ethoxyethoxy)-N-[(2R)-2-methyl-3,4-dihydro-1H-naphthalen-2-yl]propanamide
CID 95777260

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide?
The IUPAC name of (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide (CID 124826238) is (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide.
What is the SMILES notation for (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide?
The canonical SMILES for (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide is CCOCCO[C@H](C)C(=O)N[C@@H]1C[C@H]1c1ccccc1Cl.
What is the InChIKey of (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide?
The InChIKey is JZJPTWVAZDTPCR-OSAQELSMSA-N. The full InChI is InChI=1S/C16H22ClNO3/c1-3-20-8-9-21-11(2)16(19)18-15-10-13(15)12-6-4-5-7-14(12)17/h4-7,11,13,15H,3,8-10H2,1-2H3,(H,18,19)/t11-,13+,15-/m1/s1.
What are the key properties of (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide?
(2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide has a molecular weight of 311.81 g/mol, XLogP of 2.75, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1R,2S)-2-(2-chlorophenyl)cyclopropyl]-2-(2-ethoxyethoxy)propanamide is sourced from PubChem (CID 124826238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).