N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide

C10H16BrNO — CID 115594459

IUPACN-(2-bromoprop-2-enyl)-2-cyclopentylacetamide
SMILESC=C(Br)CNC(=O)CC1CCCC1
InChIInChI=1S/C10H16BrNO/c1-8(11)7-12-10(13)6-9-4-2-3-5-9/h9H,1-7H2,(H,12,13)
InChIKeyJNDDWYMMLIVBDF-UHFFFAOYSA-N
MW246.15 g/mol
LogP2.59
Rot. Bonds4

About N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide

N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide (PubChem CID 115594459) has the molecular formula C10H16BrNO and a molecular weight of 246.15 g/mol. Its IUPAC name is N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide.

Molecular Properties

Compound NameN-(2-bromoprop-2-enyl)-2-cyclopentylacetamide
PubChem CID115594459
Molecular FormulaC10H16BrNO
Molecular Weight246.15 g/mol
Exact Mass245.04
IUPAC NameN-(2-bromoprop-2-enyl)-2-cyclopentylacetamide
SMILESC=C(Br)CNC(=O)CC1CCCC1
InChIInChI=1S/C10H16BrNO/c1-8(11)7-12-10(13)6-9-4-2-3-5-9/h9H,1-7H2,(H,12,13)
InChIKeyJNDDWYMMLIVBDF-UHFFFAOYSA-N
XLogP2.59
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.15
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide?
The IUPAC name of N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide (CID 115594459) is N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide.
What is the SMILES notation for N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide?
The canonical SMILES for N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide is C=C(Br)CNC(=O)CC1CCCC1.
What is the InChIKey of N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide?
The InChIKey is JNDDWYMMLIVBDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16BrNO/c1-8(11)7-12-10(13)6-9-4-2-3-5-9/h9H,1-7H2,(H,12,13).
What are the key properties of N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide?
N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide has a molecular weight of 246.15 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromoprop-2-enyl)-2-cyclopentylacetamide is sourced from PubChem (CID 115594459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).