2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide

C11H20ClNO2 — CID 60948418

IUPAC2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide
SMILESCOCCN(C(=O)C(C)Cl)C(C)C1CC1
InChIInChI=1S/C11H20ClNO2/c1-8(12)11(14)13(6-7-15-3)9(2)10-4-5-10/h8-10H,4-7H2,1-3H3
InChIKeySPFJYAOBCSAUGX-UHFFFAOYSA-N
MW233.74 g/mol
LogP1.89
Rot. Bonds6

About 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide

2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide (PubChem CID 60948418) has the molecular formula C11H20ClNO2 and a molecular weight of 233.74 g/mol. Its IUPAC name is 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide
PubChem CID60948418
Molecular FormulaC11H20ClNO2
Molecular Weight233.74 g/mol
Exact Mass233.12
IUPAC Name2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide
SMILESCOCCN(C(=O)C(C)Cl)C(C)C1CC1
InChIInChI=1S/C11H20ClNO2/c1-8(12)11(14)13(6-7-15-3)9(2)10-4-5-10/h8-10H,4-7H2,1-3H3
InChIKeySPFJYAOBCSAUGX-UHFFFAOYSA-N
XLogP1.89
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.74
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(1-cyclopropylethyl)-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide
CID 103429770
2-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-4-methylsulfonylbutanamide
CID 60946822
3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea
CID 115642256
3-tert-butyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea
CID 113256723
2-[[1-cyclopropylethyl(2-methoxyethyl)carbamoyl]-methylamino]propanoic acid
CID 62637212
cis-(1S,2R)-2-[1-cyclopropylethyl(2-methoxyethyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 114091974
5-[1-cyclopropylethyl(2-methoxyethyl)amino]-5-oxopentanoic acid
CID 54875337
N-(1-cyclopropylethyl)-2-(ethylamino)-N-(2-methoxyethyl)-2-methylpropanamide
CID 62834379
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)benzamide
CID 60794981
5-[1-cyclopropylethyl(2-methoxyethyl)amino]-3,3-dimethyl-5-oxopentanoic acid
CID 62933896
1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)cyclohexane-1-carboxamide
CID 54872120
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-4-sulfanylbenzamide
CID 107026569

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide (CID 60948418) is 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide is COCCN(C(=O)C(C)Cl)C(C)C1CC1.
What is the InChIKey of 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide?
The InChIKey is SPFJYAOBCSAUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20ClNO2/c1-8(12)11(14)13(6-7-15-3)9(2)10-4-5-10/h8-10H,4-7H2,1-3H3.
What are the key properties of 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide?
2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide has a molecular weight of 233.74 g/mol, XLogP of 1.89, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 60948418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).