2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide

C12H13Cl2NO2 — CID 115764608

IUPAC2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide
SMILESO=C(Cc1c(Cl)cccc1Cl)NC1(CO)CC1
InChIInChI=1S/C12H13Cl2NO2/c13-9-2-1-3-10(14)8(9)6-11(17)15-12(7-16)4-5-12/h1-3,16H,4-7H2,(H,15,17)
InChIKeyOVLWPEMAOCDQPS-UHFFFAOYSA-N
MW274.15 g/mol
LogP2.18
Rot. Bonds4

About 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide

2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide (PubChem CID 115764608) has the molecular formula C12H13Cl2NO2 and a molecular weight of 274.15 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide
PubChem CID115764608
Molecular FormulaC12H13Cl2NO2
Molecular Weight274.15 g/mol
Exact Mass273.03
IUPAC Name2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide
SMILESO=C(Cc1c(Cl)cccc1Cl)NC1(CO)CC1
InChIInChI=1S/C12H13Cl2NO2/c13-9-2-1-3-10(14)8(9)6-11(17)15-12(7-16)4-5-12/h1-3,16H,4-7H2,(H,15,17)
InChIKeyOVLWPEMAOCDQPS-UHFFFAOYSA-N
XLogP2.18
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.15
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclohexyl]acetamide
CID 62522014
2-(2,6-dichlorophenyl)-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide
CID 80711817
N-[1-(aminomethyl)cyclopentyl]-2-(2-chloro-6-fluorophenyl)acetamide
CID 63887000
2,6-dichloro-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 62519426
2-(3-chlorophenyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
CID 103954217
N-cyclopropyl-2-(2,6-dichlorophenyl)acetamide
CID 2682749
3-(2,4-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]propanamide
CID 115764583
2-(2,4-dichlorophenyl)-N-[1-(hydroxymethyl)cyclohexyl]acetamide
CID 62522174
methyl 4-[[2-(2,6-dichlorophenyl)acetyl]amino]-1-methylpiperidine-4-carboxylate
CID 23500828
N-(4-cyano-1-methylpiperidin-4-yl)-2-(2,6-dichlorophenyl)acetamide
CID 23500829
2,3-dichloro-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 55081718
[1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol
CID 62520254

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide (CID 115764608) is 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide is O=C(Cc1c(Cl)cccc1Cl)NC1(CO)CC1.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide?
The InChIKey is OVLWPEMAOCDQPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13Cl2NO2/c13-9-2-1-3-10(14)8(9)6-11(17)15-12(7-16)4-5-12/h1-3,16H,4-7H2,(H,15,17).
What are the key properties of 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide?
2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide has a molecular weight of 274.15 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclopropyl]acetamide is sourced from PubChem (CID 115764608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).