N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide

C17H19N3O — CID 113031855

IUPACN-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(N2CCCc3ccccc32)cn1
InChIInChI=1S/C17H19N3O/c1-2-17(21)19-16-10-9-14(12-18-16)20-11-5-7-13-6-3-4-8-15(13)20/h3-4,6,8-10,12H,2,5,7,11H2,1H3,(H,18,19,21)
InChIKeyDZYXMDCALWVUIJ-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.51
Rot. Bonds3

About N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide

N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide (PubChem CID 113031855) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide
PubChem CID113031855
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(N2CCCc3ccccc32)cn1
InChIInChI=1S/C17H19N3O/c1-2-17(21)19-16-10-9-14(12-18-16)20-11-5-7-13-6-3-4-8-15(13)20/h3-4,6,8-10,12H,2,5,7,11H2,1H3,(H,18,19,21)
InChIKeyDZYXMDCALWVUIJ-UHFFFAOYSA-N
XLogP3.51
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide?
The IUPAC name of N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide (CID 113031855) is N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide.
What is the SMILES notation for N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide?
The canonical SMILES for N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide is CCC(=O)Nc1ccc(N2CCCc3ccccc32)cn1.
What is the InChIKey of N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide?
The InChIKey is DZYXMDCALWVUIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-2-17(21)19-16-10-9-14(12-18-16)20-11-5-7-13-6-3-4-8-15(13)20/h3-4,6,8-10,12H,2,5,7,11H2,1H3,(H,18,19,21).
What are the key properties of N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide?
N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide has a molecular weight of 281.36 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide is sourced from PubChem (CID 113031855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).