N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide

C11H18BrNO — CID 115594621

IUPACN-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide
SMILESC=C(Br)CNC(=O)CCC1CCCC1
InChIInChI=1S/C11H18BrNO/c1-9(12)8-13-11(14)7-6-10-4-2-3-5-10/h10H,1-8H2,(H,13,14)
InChIKeyBQZRBSJYRDFTHO-UHFFFAOYSA-N
MW260.17 g/mol
LogP2.98
Rot. Bonds5

About N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide

N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide (PubChem CID 115594621) has the molecular formula C11H18BrNO and a molecular weight of 260.17 g/mol. Its IUPAC name is N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide.

Molecular Properties

Compound NameN-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide
PubChem CID115594621
Molecular FormulaC11H18BrNO
Molecular Weight260.17 g/mol
Exact Mass259.06
IUPAC NameN-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide
SMILESC=C(Br)CNC(=O)CCC1CCCC1
InChIInChI=1S/C11H18BrNO/c1-9(12)8-13-11(14)7-6-10-4-2-3-5-10/h10H,1-8H2,(H,13,14)
InChIKeyBQZRBSJYRDFTHO-UHFFFAOYSA-N
XLogP2.98
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.17
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide
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N-(2-chloroethyl)-3-cyclohexylpropanamide
CID 61288292
N-(2-amino-2-methylpropyl)-3-cyclopentylpropanamide
CID 81425234
3-cyclopentyl-N-(2-methylpropyl)propanamide
CID 918369
3-cyclopentyl-N-prop-2-ynylpropanamide
CID 60646217
3-[[2-(3-cyclopentylpropanoylamino)acetyl]amino]-2,2-dimethylpropanoic acid
CID 119250220
3-cyclopentyl-N-[2-[(2-cyclopentyl-2-hydroxyethyl)amino]-2-oxoethyl]propanamide
CID 111426276
3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride
CID 120945798
3-cyclopentyl-N-[2-(3-hydroxybutylamino)-2-oxoethyl]propanamide
CID 111433458

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide?
The IUPAC name of N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide (CID 115594621) is N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide.
What is the SMILES notation for N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide?
The canonical SMILES for N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide is C=C(Br)CNC(=O)CCC1CCCC1.
What is the InChIKey of N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide?
The InChIKey is BQZRBSJYRDFTHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18BrNO/c1-9(12)8-13-11(14)7-6-10-4-2-3-5-10/h10H,1-8H2,(H,13,14).
What are the key properties of N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide?
N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide has a molecular weight of 260.17 g/mol, XLogP of 2.98, 5 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)-3-cyclopentylpropanamide is sourced from PubChem (CID 115594621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).