3,4-dihydroquinoline-3-carboxamide

C10H10N2O — CID 54448978

IUPAC3,4-dihydroquinoline-3-carboxamide
SMILESNC(=O)C1C=Nc2ccccc2C1
InChIInChI=1S/C10H10N2O/c11-10(13)8-5-7-3-1-2-4-9(7)12-6-8/h1-4,6,8H,5H2,(H2,11,13)
InChIKeyWTOYMVRWGVWXAE-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.05
Rot. Bonds1

About 3,4-dihydroquinoline-3-carboxamide

3,4-dihydroquinoline-3-carboxamide (PubChem CID 54448978) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3,4-dihydroquinoline-3-carboxamide.

Molecular Properties

Compound Name3,4-dihydroquinoline-3-carboxamide
PubChem CID54448978
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3,4-dihydroquinoline-3-carboxamide
SMILESNC(=O)C1C=Nc2ccccc2C1
InChIInChI=1S/C10H10N2O/c11-10(13)8-5-7-3-1-2-4-9(7)12-6-8/h1-4,6,8H,5H2,(H2,11,13)
InChIKeyWTOYMVRWGVWXAE-UHFFFAOYSA-N
XLogP1.05
TPSA55.45 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 ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydroquinoline-3-carboxamide?
The IUPAC name of 3,4-dihydroquinoline-3-carboxamide (CID 54448978) is 3,4-dihydroquinoline-3-carboxamide.
What is the SMILES notation for 3,4-dihydroquinoline-3-carboxamide?
The canonical SMILES for 3,4-dihydroquinoline-3-carboxamide is NC(=O)C1C=Nc2ccccc2C1.
What is the InChIKey of 3,4-dihydroquinoline-3-carboxamide?
The InChIKey is WTOYMVRWGVWXAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c11-10(13)8-5-7-3-1-2-4-9(7)12-6-8/h1-4,6,8H,5H2,(H2,11,13).
What are the key properties of 3,4-dihydroquinoline-3-carboxamide?
3,4-dihydroquinoline-3-carboxamide has a molecular weight of 174.20 g/mol, XLogP of 1.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydroquinoline-3-carboxamide is sourced from PubChem (CID 54448978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).