potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate

C15H27KN2O2 — CID 158300860

IUPACpotassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate
SMILESC=C1CC2CN(C(=O)N(C)C)CC2C1.CC(C)(C)[O-].[K+]
InChIInChI=1S/C11H18N2O.C4H9O.K/c1-8-4-9-6-13(7-10(9)5-8)11(14)12(2)3;1-4(2,3)5;/h9-10H,1,4-7H2,2-3H3;1-3H3;/q;-1;+1
InChIKeyGMMCPGQOGVFGGX-UHFFFAOYSA-N
MW306.49 g/mol
LogP-1.28
Rot. Bonds

About potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate

potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate (PubChem CID 158300860) has the molecular formula C15H27KN2O2 and a molecular weight of 306.49 g/mol. Its IUPAC name is potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate.

Molecular Properties

Compound Namepotassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate
PubChem CID158300860
Molecular FormulaC15H27KN2O2
Molecular Weight306.49 g/mol
Exact Mass306.17
IUPAC Namepotassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate
SMILESC=C1CC2CN(C(=O)N(C)C)CC2C1.CC(C)(C)[O-].[K+]
InChIInChI=1S/C11H18N2O.C4H9O.K/c1-8-4-9-6-13(7-10(9)5-8)11(14)12(2)3;1-4(2,3)5;/h9-10H,1,4-7H2,2-3H3;1-3H3;/q;-1;+1
InChIKeyGMMCPGQOGVFGGX-UHFFFAOYSA-N
XLogP-1.28
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.49
LogP ≤ 5-1.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate?
The IUPAC name of potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate (CID 158300860) is potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate.
What is the SMILES notation for potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate?
The canonical SMILES for potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate is C=C1CC2CN(C(=O)N(C)C)CC2C1.CC(C)(C)[O-].[K+].
What is the InChIKey of potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate?
The InChIKey is GMMCPGQOGVFGGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O.C4H9O.K/c1-8-4-9-6-13(7-10(9)5-8)11(14)12(2)3;1-4(2,3)5;/h9-10H,1,4-7H2,2-3H3;1-3H3;/q;-1;+1.
What are the key properties of potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate?
potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate has a molecular weight of 306.49 g/mol, XLogP of -1.28, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;N,N-dimethyl-5-methylidene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide;2-methylpropan-2-olate is sourced from PubChem (CID 158300860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).