N-(2-bromoprop-2-enyl)pentanamide

C8H14BrNO — CID 115594418

IUPACN-(2-bromoprop-2-enyl)pentanamide
SMILESC=C(Br)CNC(=O)CCCC
InChIInChI=1S/C8H14BrNO/c1-3-4-5-8(11)10-6-7(2)9/h2-6H2,1H3,(H,10,11)
InChIKeyHCIVYGVYVGHPQV-UHFFFAOYSA-N
MW220.11 g/mol
LogP2.20
Rot. Bonds5

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

N-(2-bromoprop-2-enyl)pentanamide (PubChem CID 115594418) has the molecular formula C8H14BrNO and a molecular weight of 220.11 g/mol. Its IUPAC name is N-(2-bromoprop-2-enyl)pentanamide.

Molecular Properties

Compound NameN-(2-bromoprop-2-enyl)pentanamide
PubChem CID115594418
Molecular FormulaC8H14BrNO
Molecular Weight220.11 g/mol
Exact Mass219.03
IUPAC NameN-(2-bromoprop-2-enyl)pentanamide
SMILESC=C(Br)CNC(=O)CCCC
InChIInChI=1S/C8H14BrNO/c1-3-4-5-8(11)10-6-7(2)9/h2-6H2,1H3,(H,10,11)
InChIKeyHCIVYGVYVGHPQV-UHFFFAOYSA-N
XLogP2.20
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.11
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Butyramide, N-(2-bromoallyl)-
CID 57964
Propionamide, N-(2-bromoallyl)-
CID 3064432
N-(2-methylprop-2-enyl)pentanamide
CID 114618785
N-(2-bromoprop-2-enyl)-1-fluorocyclobutane-1-carboxamide
CID 130658591
N-prop-2-enylpentanamide
CID 3515214
ethane;N-(2-methylprop-2-enyl)pentanamide
CID 153377283
5-bromo-N-prop-2-enylpentanamide
CID 10489076
N-buta-2,3-dienylpentanamide
CID 71475189
(2R)-2-amino-N-(2-bromoprop-2-enyl)pentanamide
CID 103795948
N-(2-bromoprop-2-enyl)hept-6-ynamide
CID 103908288
5-amino-N-(2-bromoprop-2-enyl)pentanamide
CID 104069590
5-bromo-N-(3-methylbut-2-enyl)pentanamide
CID 106186058

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoprop-2-enyl)pentanamide?
The IUPAC name of N-(2-bromoprop-2-enyl)pentanamide (CID 115594418) is N-(2-bromoprop-2-enyl)pentanamide.
What is the SMILES notation for N-(2-bromoprop-2-enyl)pentanamide?
The canonical SMILES for N-(2-bromoprop-2-enyl)pentanamide is C=C(Br)CNC(=O)CCCC.
What is the InChIKey of N-(2-bromoprop-2-enyl)pentanamide?
The InChIKey is HCIVYGVYVGHPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14BrNO/c1-3-4-5-8(11)10-6-7(2)9/h2-6H2,1H3,(H,10,11).
What are the key properties of N-(2-bromoprop-2-enyl)pentanamide?
N-(2-bromoprop-2-enyl)pentanamide has a molecular weight of 220.11 g/mol, XLogP of 2.20, 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)pentanamide is sourced from PubChem (CID 115594418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).