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

C14H19NO — CID 15204421

IUPACN,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
SMILESC=CCN(CC=C)C(=O)C1CC2C=CC1C2
InChIInChI=1S/C14H19NO/c1-3-7-15(8-4-2)14(16)13-10-11-5-6-12(13)9-11/h3-6,11-13H,1-2,7-10H2
InChIKeyRWQPYKVSALYDDB-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.40
Rot. Bonds5

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

N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide (PubChem CID 15204421) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
PubChem CID15204421
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC NameN,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
SMILESC=CCN(CC=C)C(=O)C1CC2C=CC1C2
InChIInChI=1S/C14H19NO/c1-3-7-15(8-4-2)14(16)13-10-11-5-6-12(13)9-11/h3-6,11-13H,1-2,7-10H2
InChIKeyRWQPYKVSALYDDB-UHFFFAOYSA-N
XLogP2.40
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-prop-2-enylbicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 54017402
(1R,2R,4S)-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enylbicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 98180033
2-[bicyclo[2.2.1]hept-5-ene-2-carbonyl(cyclopropyl)amino]acetic acid
CID 54946073
N,N-diethoxybicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 87822883
N-(2-hydroxyethyl)-N-(pyrrolidin-2-ylmethyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 106612908
methyl 3-[bicyclo[2.2.1]hept-5-ene-2-carbonyl(ethyl)amino]propanoate
CID 54898736
N-ethyl-N-piperidin-4-ylbicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 54923298
N-ethyl-N-(piperidin-3-ylmethyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 106629590
2-[(1S,4S)-2-bicyclo[2.2.1]hept-5-enyl]-2-oxoacetaldehyde
CID 163214887
2-[bis(prop-2-enyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid
CID 114390269
bicyclo[2.2.1]hept-5-ene-2-carbothioic S-acid
CID 139905426
1-[(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethanone
CID 11869221

Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide?
The IUPAC name of N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide (CID 15204421) is N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide.
What is the SMILES notation for N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide?
The canonical SMILES for N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide is C=CCN(CC=C)C(=O)C1CC2C=CC1C2.
What is the InChIKey of N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide?
The InChIKey is RWQPYKVSALYDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-3-7-15(8-4-2)14(16)13-10-11-5-6-12(13)9-11/h3-6,11-13H,1-2,7-10H2.
What are the key properties of N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide?
N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide has a molecular weight of 217.31 g/mol, XLogP of 2.40, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide is sourced from PubChem (CID 15204421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).