2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide

C13H16ClNO2 — CID 43576750

IUPAC2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)N(CCO)C1CC1
InChIInChI=1S/C13H16ClNO2/c14-11-3-1-10(2-4-11)9-13(17)15(7-8-16)12-5-6-12/h1-4,12,16H,5-9H2
InChIKeyWCODWPWJWFWYKQ-UHFFFAOYSA-N
MW253.73 g/mol
LogP1.87
Rot. Bonds5

About 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide

2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide (PubChem CID 43576750) has the molecular formula C13H16ClNO2 and a molecular weight of 253.73 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide
PubChem CID43576750
Molecular FormulaC13H16ClNO2
Molecular Weight253.73 g/mol
Exact Mass253.09
IUPAC Name2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)N(CCO)C1CC1
InChIInChI=1S/C13H16ClNO2/c14-11-3-1-10(2-4-11)9-13(17)15(7-8-16)12-5-6-12/h1-4,12,16H,5-9H2
InChIKeyWCODWPWJWFWYKQ-UHFFFAOYSA-N
XLogP1.87
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.73
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide
CID 102866603
N-(2-chloroethyl)-2-(4-chlorophenyl)-N-cyclohexylacetamide
CID 63391287
2-[4-(aminomethyl)phenyl]-N-cyclobutyl-N-(2-hydroxyethyl)acetamide
CID 102858984
N-cyclobutyl-2-(3,4-dichlorophenyl)-N-(2-hydroxyethyl)acetamide
CID 102684283
N-(3-amino-3-hydroxyiminopropyl)-2-(4-chlorophenyl)-N-cyclopropylacetamide
CID 76911867
3-(4-chlorophenyl)sulfanyl-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
CID 43577284
N-cyclobutyl-N-(2-hydroxyethyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 102684894
2-(4-chlorophenyl)-N-ethyl-N-piperidin-4-ylacetamide
CID 60806745
N-(2-chloroethyl)-N-cyclopropyl-2-phenylacetamide
CID 63394434
N-(3-aminopropyl)-N-cyclopropyl-2-(4-fluorophenyl)acetamide
CID 43136754
N-(4-aminocyclohexyl)-2-(4-chlorophenyl)-N-methylacetamide
CID 79121866
N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide
CID 60801057

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide (CID 43576750) is 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide is O=C(Cc1ccc(Cl)cc1)N(CCO)C1CC1.
What is the InChIKey of 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide?
The InChIKey is WCODWPWJWFWYKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClNO2/c14-11-3-1-10(2-4-11)9-13(17)15(7-8-16)12-5-6-12/h1-4,12,16H,5-9H2.
What are the key properties of 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide?
2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide has a molecular weight of 253.73 g/mol, XLogP of 1.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 43576750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).