4H-quinolizine-1-carboxamide

C10H10N2O — CID 19872364

IUPAC4H-quinolizine-1-carboxamide
SMILESNC(=O)C1=C2C=CC=CN2CC=C1
InChIInChI=1S/C10H10N2O/c11-10(13)8-4-3-7-12-6-2-1-5-9(8)12/h1-6H,7H2,(H2,11,13)
InChIKeyRCBXYFZIDIIHRB-UHFFFAOYSA-N
MW174.20 g/mol
LogP0.68
Rot. Bonds1

About 4H-quinolizine-1-carboxamide

4H-quinolizine-1-carboxamide (PubChem CID 19872364) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 4H-quinolizine-1-carboxamide.

Molecular Properties

Compound Name4H-quinolizine-1-carboxamide
PubChem CID19872364
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name4H-quinolizine-1-carboxamide
SMILESNC(=O)C1=C2C=CC=CN2CC=C1
InChIInChI=1S/C10H10N2O/c11-10(13)8-4-3-7-12-6-2-1-5-9(8)12/h1-6H,7H2,(H2,11,13)
InChIKeyRCBXYFZIDIIHRB-UHFFFAOYSA-N
XLogP0.68
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4H-quinolizine-1-carboxamide?
The IUPAC name of 4H-quinolizine-1-carboxamide (CID 19872364) is 4H-quinolizine-1-carboxamide.
What is the SMILES notation for 4H-quinolizine-1-carboxamide?
The canonical SMILES for 4H-quinolizine-1-carboxamide is NC(=O)C1=C2C=CC=CN2CC=C1.
What is the InChIKey of 4H-quinolizine-1-carboxamide?
The InChIKey is RCBXYFZIDIIHRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c11-10(13)8-4-3-7-12-6-2-1-5-9(8)12/h1-6H,7H2,(H2,11,13).
What are the key properties of 4H-quinolizine-1-carboxamide?
4H-quinolizine-1-carboxamide has a molecular weight of 174.20 g/mol, XLogP of 0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-quinolizine-1-carboxamide is sourced from PubChem (CID 19872364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).