N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide

C15H14N2O2 — CID 166427421

IUPACN-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide
SMILESO=C(NCc1cc(=O)[nH]c2ccccc12)C12CC1C2
InChIInChI=1S/C15H14N2O2/c18-13-5-9(11-3-1-2-4-12(11)17-13)8-16-14(19)15-6-10(15)7-15/h1-5,10H,6-8H2,(H,16,19)(H,17,18)
InChIKeyXIXJSYHAMHDHFC-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.55
Rot. Bonds3

About N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide

N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide (PubChem CID 166427421) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide.

Molecular Properties

Compound NameN-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide
PubChem CID166427421
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC NameN-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide
SMILESO=C(NCc1cc(=O)[nH]c2ccccc12)C12CC1C2
InChIInChI=1S/C15H14N2O2/c18-13-5-9(11-3-1-2-4-12(11)17-13)8-16-14(19)15-6-10(15)7-15/h1-5,10H,6-8H2,(H,16,19)(H,17,18)
InChIKeyXIXJSYHAMHDHFC-UHFFFAOYSA-N
XLogP1.55
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide?
The IUPAC name of N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide (CID 166427421) is N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide.
What is the SMILES notation for N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide?
The canonical SMILES for N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide is O=C(NCc1cc(=O)[nH]c2ccccc12)C12CC1C2.
What is the InChIKey of N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide?
The InChIKey is XIXJSYHAMHDHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c18-13-5-9(11-3-1-2-4-12(11)17-13)8-16-14(19)15-6-10(15)7-15/h1-5,10H,6-8H2,(H,16,19)(H,17,18).
What are the key properties of N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide?
N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide has a molecular weight of 254.29 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-oxo-1H-quinolin-4-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide is sourced from PubChem (CID 166427421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).