N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide

C11H18BrNO — CID 104917114

IUPACN-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide
SMILESC=C(Br)CNC(=O)C1CCCC1(C)C
InChIInChI=1S/C11H18BrNO/c1-8(12)7-13-10(14)9-5-4-6-11(9,2)3/h9H,1,4-7H2,2-3H3,(H,13,14)
InChIKeyYRYFNNHZSXFSRV-UHFFFAOYSA-N
MW260.17 g/mol
LogP2.84
Rot. Bonds3

About N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide

N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide (PubChem CID 104917114) has the molecular formula C11H18BrNO and a molecular weight of 260.17 g/mol. Its IUPAC name is N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide
PubChem CID104917114
Molecular FormulaC11H18BrNO
Molecular Weight260.17 g/mol
Exact Mass259.06
IUPAC NameN-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide
SMILESC=C(Br)CNC(=O)C1CCCC1(C)C
InChIInChI=1S/C11H18BrNO/c1-8(12)7-13-10(14)9-5-4-6-11(9,2)3/h9H,1,4-7H2,2-3H3,(H,13,14)
InChIKeyYRYFNNHZSXFSRV-UHFFFAOYSA-N
XLogP2.84
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.17
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-dimethyl-N-(2-oxopropyl)cyclohexane-1-carboxamide
CID 107178834
N-(4-bromobutyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 107184530
N-(3-hydroxy-2-methylpropyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 104918370
N-[[1-(chloromethyl)cyclopentyl]methyl]-2,2-dimethylcyclopentane-1-carboxamide
CID 107184226
N-[(3-bromocyclopentyl)methyl]-2,2-dimethylcyclopentane-1-carboxamide
CID 106128288
N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 107181003
N-(2,3-dihydroxy-2-methylpropyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 107180415
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-2,2-dimethylcyclopentane-1-carboxamide
CID 107184438
N-[[2-(bromomethyl)cyclohexyl]methyl]-2,2-dimethylcyclohexane-1-carboxamide
CID 107184222
N-(2-cyanopropyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 104919622
N-(2-bromoprop-2-enyl)-1-methylcyclopentane-1-carboxamide
CID 115612271
N-(2-bromoprop-2-enyl)-1-methylcyclobutane-1-carboxamide
CID 130634322

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide?
The IUPAC name of N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide (CID 104917114) is N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide?
The canonical SMILES for N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide is C=C(Br)CNC(=O)C1CCCC1(C)C.
What is the InChIKey of N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide?
The InChIKey is YRYFNNHZSXFSRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18BrNO/c1-8(12)7-13-10(14)9-5-4-6-11(9,2)3/h9H,1,4-7H2,2-3H3,(H,13,14).
What are the key properties of N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide?
N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide has a molecular weight of 260.17 g/mol, XLogP of 2.84, 3 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)-2,2-dimethylcyclopentane-1-carboxamide is sourced from PubChem (CID 104917114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).