1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide

C15H20N2O2 — CID 174429804

IUPAC1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide
SMILESC=CCN(CC=C)C(=O)C12C=CC(CC1C(N)=O)C2
InChIInChI=1S/C15H20N2O2/c1-3-7-17(8-4-2)14(19)15-6-5-11(10-15)9-12(15)13(16)18/h3-6,11-12H,1-2,7-10H2,(H2,16,18)
InChIKeyHZQNVBWRCUEEDW-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.25
Rot. Bonds6

About 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide

1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide (PubChem CID 174429804) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide
PubChem CID174429804
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide
SMILESC=CCN(CC=C)C(=O)C12C=CC(CC1C(N)=O)C2
InChIInChI=1S/C15H20N2O2/c1-3-7-17(8-4-2)14(19)15-6-5-11(10-15)9-12(15)13(16)18/h3-6,11-12H,1-2,7-10H2,(H2,16,18)
InChIKeyHZQNVBWRCUEEDW-UHFFFAOYSA-N
XLogP1.25
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-amino-N,N-bis(prop-2-enyl)cyclopropane-1-carboxamide
CID 65464830
N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 15204421
1-(4-aminophenyl)-N,N-bis(prop-2-enyl)cyclopropane-1-carboxamide
CID 112558169
bis(prop-2-enyl)carbamothioic S-acid;carbamothioic S-acid
CID 87059651
(1-prop-2-enyl-2-bicyclo[2.2.1]hept-5-enyl) hydrogen carbonate
CID 70350439
3-ethyl-N,N-bis(prop-2-enyl)oxetane-3-carboxamide
CID 84579166
N-(1-adamantyl)-N',N'-bis(prop-2-enyl)oxamide
CID 108516835
3-[bis(prop-2-enyl)carbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 64837646
2-[bis(prop-2-enyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid
CID 114390269
N,N-bis(prop-2-enyl)carbamoyl fluoride
CID 21354913
2-oxoethyl(prop-2-enyl)carbamic acid
CID 22125686
amino N,N-bis(prop-2-enyl)carbamate
CID 88511784

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide?
The IUPAC name of 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide (CID 174429804) is 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide.
What is the SMILES notation for 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide?
The canonical SMILES for 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide is C=CCN(CC=C)C(=O)C12C=CC(CC1C(N)=O)C2.
What is the InChIKey of 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide?
The InChIKey is HZQNVBWRCUEEDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-7-17(8-4-2)14(19)15-6-5-11(10-15)9-12(15)13(16)18/h3-6,11-12H,1-2,7-10H2,(H2,16,18).
What are the key properties of 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide?
1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide has a molecular weight of 260.34 g/mol, XLogP of 1.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-1,2-dicarboxamide is sourced from PubChem (CID 174429804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).