N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide

C11H16N2O — CID 4090822

IUPACN-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide
SMILESO=C(NN=C1CC2CCC1C2)C1CC1
InChIInChI=1S/C11H16N2O/c14-11(8-3-4-8)13-12-10-6-7-1-2-9(10)5-7/h7-9H,1-6H2,(H,13,14)
InChIKeyNHLNEIJLTIXMDK-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.69
Rot. Bonds2

About N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide

N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide (PubChem CID 4090822) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide
PubChem CID4090822
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide
SMILESO=C(NN=C1CC2CCC1C2)C1CC1
InChIInChI=1S/C11H16N2O/c14-11(8-3-4-8)13-12-10-6-7-1-2-9(10)5-7/h7-9H,1-6H2,(H,13,14)
InChIKeyNHLNEIJLTIXMDK-UHFFFAOYSA-N
XLogP1.69
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis[(Z)-[(1S,4S)-2-bicyclo[2.2.1]heptanylidene]amino]oxamide
CID 98829133
N-(2-bicyclo[2.2.1]heptanylideneamino)-4-methylbenzamide
CID 4141533
N-[(E)-[(1S,4R)-2-bicyclo[2.2.1]heptanylidene]amino]-4-(dimethylamino)benzamide
CID 28742334
N-(2-bicyclo[2.2.1]heptanylideneamino)-4-(dimethylamino)benzamide
CID 3343667
N-[(Z)-[(1R,4R)-2-bicyclo[2.2.1]heptanylidene]amino]pyridine-2-carboxamide
CID 98111329
N-[(E)-[(1S,4S)-2-bicyclo[2.2.1]heptanylidene]amino]pyridine-2-carboxamide
CID 98475772
N-(2-bicyclo[2.2.1]heptanylideneamino)-4-methoxybenzamide
CID 4251233
N-[(E)-[(1S,4R)-2-bicyclo[2.2.1]heptanylidene]amino]-5-methylthiophene-3-carboxamide
CID 27451247
N-[(Z)-[(1S,4R)-2-bicyclo[2.2.1]heptanylidene]amino]-3-chlorobenzamide
CID 40554029
N-[(Z)-[(1R,4R)-2-bicyclo[2.2.1]heptanylidene]amino]-2-methoxybenzamide
CID 98289762
N-[(E)-[(1S,4S)-2-bicyclo[2.2.1]heptanylidene]amino]-3,4,5-trimethoxybenzamide
CID 7308879
N-[(Z)-[(1S,4S)-2-bicyclo[2.2.1]heptanylidene]amino]-3,4-dimethoxybenzamide
CID 98504378

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide (CID 4090822) is N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide is O=C(NN=C1CC2CCC1C2)C1CC1.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide?
The InChIKey is NHLNEIJLTIXMDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c14-11(8-3-4-8)13-12-10-6-7-1-2-9(10)5-7/h7-9H,1-6H2,(H,13,14).
What are the key properties of N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide?
N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide has a molecular weight of 192.26 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylideneamino)cyclopropanecarboxamide is sourced from PubChem (CID 4090822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).