N-(2-bromocyclopentyl)-2-cyclopropylacetamide

C10H16BrNO — CID 80662940

IUPACN-(2-bromocyclopentyl)-2-cyclopropylacetamide
SMILESO=C(CC1CC1)NC1CCCC1Br
InChIInChI=1S/C10H16BrNO/c11-8-2-1-3-9(8)12-10(13)6-7-4-5-7/h7-9H,1-6H2,(H,12,13)
InChIKeyLAVQXASRJKPUSY-UHFFFAOYSA-N
MW246.15 g/mol
LogP2.22
Rot. Bonds3

About N-(2-bromocyclopentyl)-2-cyclopropylacetamide

N-(2-bromocyclopentyl)-2-cyclopropylacetamide (PubChem CID 80662940) has the molecular formula C10H16BrNO and a molecular weight of 246.15 g/mol. Its IUPAC name is N-(2-bromocyclopentyl)-2-cyclopropylacetamide.

Molecular Properties

Compound NameN-(2-bromocyclopentyl)-2-cyclopropylacetamide
PubChem CID80662940
Molecular FormulaC10H16BrNO
Molecular Weight246.15 g/mol
Exact Mass245.04
IUPAC NameN-(2-bromocyclopentyl)-2-cyclopropylacetamide
SMILESO=C(CC1CC1)NC1CCCC1Br
InChIInChI=1S/C10H16BrNO/c11-8-2-1-3-9(8)12-10(13)6-7-4-5-7/h7-9H,1-6H2,(H,12,13)
InChIKeyLAVQXASRJKPUSY-UHFFFAOYSA-N
XLogP2.22
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.15
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2-bromocyclopentyl)-2-cyclobutylacetamide
CID 103164390
N-(2-bromocyclopentyl)-2-cycloheptylacetamide
CID 114458260
N-[2-(chloromethyl)cyclopentyl]-2-cyclopropylacetamide
CID 106365797
N-[2-(bromomethyl)cyclopentyl]-2-cyclopentylacetamide
CID 106366407
N-(2-aminocyclopentyl)-2-cyclohexylacetamide
CID 63251405
2-cyclopropyl-N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]acetamide
CID 76978603
2-cyclohexyl-N-[2-(hydroxymethyl)cyclopentyl]acetamide
CID 103751275
N-cyclopentyl-2-cyclopropylacetamide
CID 60753480
N-(2-cyanocyclopentyl)-2-cyclopentylacetamide
CID 62961621
2-cyclopentyl-N-[(1R,2R,3R)-2,3-dihydroxycycloheptyl]acetamide
CID 110125825
N-(2-bromocyclopentyl)-2-(2-chlorophenyl)acetamide
CID 80662926
N-(2-bromocyclopentyl)-3-(oxolan-2-yl)propanamide
CID 80661636

Frequently Asked Questions

What is the IUPAC name of N-(2-bromocyclopentyl)-2-cyclopropylacetamide?
The IUPAC name of N-(2-bromocyclopentyl)-2-cyclopropylacetamide (CID 80662940) is N-(2-bromocyclopentyl)-2-cyclopropylacetamide.
What is the SMILES notation for N-(2-bromocyclopentyl)-2-cyclopropylacetamide?
The canonical SMILES for N-(2-bromocyclopentyl)-2-cyclopropylacetamide is O=C(CC1CC1)NC1CCCC1Br.
What is the InChIKey of N-(2-bromocyclopentyl)-2-cyclopropylacetamide?
The InChIKey is LAVQXASRJKPUSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16BrNO/c11-8-2-1-3-9(8)12-10(13)6-7-4-5-7/h7-9H,1-6H2,(H,12,13).
What are the key properties of N-(2-bromocyclopentyl)-2-cyclopropylacetamide?
N-(2-bromocyclopentyl)-2-cyclopropylacetamide has a molecular weight of 246.15 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromocyclopentyl)-2-cyclopropylacetamide is sourced from PubChem (CID 80662940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).