N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide

C11H17ClN2O — CID 115868404

IUPACN-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide
SMILESC=C(Cl)CNC(=O)C1CC12CCNCC2
InChIInChI=1S/C11H17ClN2O/c1-8(12)7-14-10(15)9-6-11(9)2-4-13-5-3-11/h9,13H,1-7H2,(H,14,15)
InChIKeyCHCUXPPCODUHNA-UHFFFAOYSA-N
MW228.72 g/mol
LogP1.24
Rot. Bonds3

About N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide

N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide (PubChem CID 115868404) has the molecular formula C11H17ClN2O and a molecular weight of 228.72 g/mol. Its IUPAC name is N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide.

Molecular Properties

Compound NameN-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide
PubChem CID115868404
Molecular FormulaC11H17ClN2O
Molecular Weight228.72 g/mol
Exact Mass228.10
IUPAC NameN-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide
SMILESC=C(Cl)CNC(=O)C1CC12CCNCC2
InChIInChI=1S/C11H17ClN2O/c1-8(12)7-14-10(15)9-6-11(9)2-4-13-5-3-11/h9,13H,1-7H2,(H,14,15)
InChIKeyCHCUXPPCODUHNA-UHFFFAOYSA-N
XLogP1.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.72
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromoprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 115868385
N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 112547931
N-(2-hydroxy-2-methylpropyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 65107462
N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 114756868
N-[2-(dimethylcarbamoylamino)ethyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 83110512
N-[(4-ethylphenyl)methyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 103872581
N-(2-methylprop-2-enyl)spiro[2.3]hexane-2-carboxamide
CID 130891244
N-[3-(methanesulfonamido)propyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 103872583
N-[(1-methylpyrrol-2-yl)methyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 106416786
N-(3-oxo-3-piperidin-1-ylpropyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 115868377
5-(6-azaspiro[2.5]octane-2-carbonylamino)-2-methylpentanoic acid
CID 104685675
6-azaspiro[2.5]octane-2-carboxylic acid
CID 51342230

Frequently Asked Questions

What is the IUPAC name of N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide?
The IUPAC name of N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide (CID 115868404) is N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide.
What is the SMILES notation for N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide?
The canonical SMILES for N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide is C=C(Cl)CNC(=O)C1CC12CCNCC2.
What is the InChIKey of N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide?
The InChIKey is CHCUXPPCODUHNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O/c1-8(12)7-14-10(15)9-6-11(9)2-4-13-5-3-11/h9,13H,1-7H2,(H,14,15).
What are the key properties of N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide?
N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide has a molecular weight of 228.72 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide is sourced from PubChem (CID 115868404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).