N-prop-2-enylspiro[2.3]hexane-2-carboxamide

C10H15NO — CID 131019470

IUPACN-prop-2-enylspiro[2.3]hexane-2-carboxamide
SMILESC=CCNC(=O)C1CC12CCC2
InChIInChI=1S/C10H15NO/c1-2-6-11-9(12)8-7-10(8)4-3-5-10/h2,8H,1,3-7H2,(H,11,12)
InChIKeyIDONYIWCDCBQME-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.48
Rot. Bonds3

About N-prop-2-enylspiro[2.3]hexane-2-carboxamide

N-prop-2-enylspiro[2.3]hexane-2-carboxamide (PubChem CID 131019470) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is N-prop-2-enylspiro[2.3]hexane-2-carboxamide.

Molecular Properties

Compound NameN-prop-2-enylspiro[2.3]hexane-2-carboxamide
PubChem CID131019470
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC NameN-prop-2-enylspiro[2.3]hexane-2-carboxamide
SMILESC=CCNC(=O)C1CC12CCC2
InChIInChI=1S/C10H15NO/c1-2-6-11-9(12)8-7-10(8)4-3-5-10/h2,8H,1,3-7H2,(H,11,12)
InChIKeyIDONYIWCDCBQME-UHFFFAOYSA-N
XLogP1.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(2-fluoroethyl)spiro[2.3]hexane-2-carboxamide
CID 126996520
2-tert-butyl-4,4-dimethyl-N-prop-2-enylpentanamide
CID 88560556
4,4-dimethyl-2-propan-2-yl-N-prop-2-enylpentanamide
CID 89151531
2,4,4-trimethyl-2-propan-2-yl-N-prop-2-enylpentanamide
CID 89362793
N-[(E)-but-2-enyl]spiro[2.2]pentane-2-carboxamide
CID 178010260
N-[(E)-but-2-enyl]spiro[2.2]pentane-2-carboxamide;molecular hydrogen
CID 178010860
N-[(E)-but-2-enyl]spiro[2.3]hexane-2-carboxamide
CID 178010950
N-Allyl-6-azaspiro[2.5]octane-1-carboxamide, AldrichCPR
CID 64069539
4-(2-aminoethyl)-5,5-dimethyl-N-prop-2-enylhexanamide
CID 64358586
2,2,3,3-tetramethyl-N-prop-2-enylcyclopropane-1-carboxamide
CID 66476353
1-methyl-3-propan-2-yl-N-prop-2-enylcyclopentane-1-carboxamide
CID 73893088
N-prop-2-enylbicyclo[3.1.0]hexane-6-carboxamide
CID 79600464

Frequently Asked Questions

What is the IUPAC name of N-prop-2-enylspiro[2.3]hexane-2-carboxamide?
The IUPAC name of N-prop-2-enylspiro[2.3]hexane-2-carboxamide (CID 131019470) is N-prop-2-enylspiro[2.3]hexane-2-carboxamide.
What is the SMILES notation for N-prop-2-enylspiro[2.3]hexane-2-carboxamide?
The canonical SMILES for N-prop-2-enylspiro[2.3]hexane-2-carboxamide is C=CCNC(=O)C1CC12CCC2.
What is the InChIKey of N-prop-2-enylspiro[2.3]hexane-2-carboxamide?
The InChIKey is IDONYIWCDCBQME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-2-6-11-9(12)8-7-10(8)4-3-5-10/h2,8H,1,3-7H2,(H,11,12).
What are the key properties of N-prop-2-enylspiro[2.3]hexane-2-carboxamide?
N-prop-2-enylspiro[2.3]hexane-2-carboxamide has a molecular weight of 165.24 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enylspiro[2.3]hexane-2-carboxamide is sourced from PubChem (CID 131019470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).