3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide

C15H20N2O — CID 143295596

IUPAC3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide
SMILESC=C1CC(CCC(=O)NCCc2ccccn2)C1
InChIInChI=1S/C15H20N2O/c1-12-10-13(11-12)5-6-15(18)17-9-7-14-4-2-3-8-16-14/h2-4,8,13H,1,5-7,9-11H2,(H,17,18)
InChIKeyCFANKCWRKRWTHY-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.49
Rot. Bonds6

About 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide

3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide (PubChem CID 143295596) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide.

Molecular Properties

Compound Name3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide
PubChem CID143295596
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide
SMILESC=C1CC(CCC(=O)NCCc2ccccn2)C1
InChIInChI=1S/C15H20N2O/c1-12-10-13(11-12)5-6-15(18)17-9-7-14-4-2-3-8-16-14/h2-4,8,13H,1,5-7,9-11H2,(H,17,18)
InChIKeyCFANKCWRKRWTHY-UHFFFAOYSA-N
XLogP2.49
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.49
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

3-(2-hydroxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide
CID 47141809
3-(4-fluorophenyl)sulfanyl-N-(2-pyridin-2-ylethyl)propanamide
CID 51072652
4-pyridin-2-yl-N-(3-pyridin-2-ylpropyl)butanamide
CID 166230056
(2S)-2-amino-5-oxo-5-(2-pyridin-2-ylethylamino)pentanoic acid
CID 69303223
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)acetamide
CID 79608018
2-pyridin-2-ylethylcarbamothioic S-acid
CID 87074091
N-[2-(cycloheptylamino)ethyl]-3-pyridin-2-ylpropanamide
CID 81485895
5-amino-N-(2-pyridin-2-ylethyl)hexanamide
CID 82848295
N-(2-pyridin-2-ylethyl)cyclopentanecarboxamide
CID 110872250
3-(3-chlorophenyl)-N-(2-pyridin-2-ylethyl)propanamide
CID 47141858
N-[2-(ethylamino)ethyl]-3-pyridin-2-ylpropanamide
CID 81479078
4-(4-fluorophenoxy)-N-(2-pyridin-2-ylethyl)butanamide
CID 86920418

Frequently Asked Questions

What is the IUPAC name of 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide?
The IUPAC name of 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide (CID 143295596) is 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide.
What is the SMILES notation for 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide?
The canonical SMILES for 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide is C=C1CC(CCC(=O)NCCc2ccccn2)C1.
What is the InChIKey of 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide?
The InChIKey is CFANKCWRKRWTHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-12-10-13(11-12)5-6-15(18)17-9-7-14-4-2-3-8-16-14/h2-4,8,13H,1,5-7,9-11H2,(H,17,18).
What are the key properties of 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide?
3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide has a molecular weight of 244.34 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methylidenecyclobutyl)-N-(2-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 143295596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).