N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide

C23H21N5O — CID 58653171

IUPACN-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide
SMILESO=C(Nc1cncc2cnccc12)C1CCN(c2cnc3ccccc3c2)CC1
InChIInChI=1S/C23H21N5O/c29-23(27-22-15-25-13-18-12-24-8-5-20(18)22)16-6-9-28(10-7-16)19-11-17-3-1-2-4-21(17)26-14-19/h1-5,8,11-16H,6-7,9-10H2,(H,27,29)
InChIKeyLIZBGAUFBPPYAM-UHFFFAOYSA-N
MW383.45 g/mol
LogP4.03
Rot. Bonds3

About N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide

N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide (PubChem CID 58653171) has the molecular formula C23H21N5O and a molecular weight of 383.45 g/mol. Its IUPAC name is N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide
PubChem CID58653171
Molecular FormulaC23H21N5O
Molecular Weight383.45 g/mol
Exact Mass383.17
IUPAC NameN-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide
SMILESO=C(Nc1cncc2cnccc12)C1CCN(c2cnc3ccccc3c2)CC1
InChIInChI=1S/C23H21N5O/c29-23(27-22-15-25-13-18-12-24-8-5-20(18)22)16-6-9-28(10-7-16)19-11-17-3-1-2-4-21(17)26-14-19/h1-5,8,11-16H,6-7,9-10H2,(H,27,29)
InChIKeyLIZBGAUFBPPYAM-UHFFFAOYSA-N
XLogP4.03
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide?
The IUPAC name of N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide (CID 58653171) is N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide is O=C(Nc1cncc2cnccc12)C1CCN(c2cnc3ccccc3c2)CC1.
What is the InChIKey of N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide?
The InChIKey is LIZBGAUFBPPYAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O/c29-23(27-22-15-25-13-18-12-24-8-5-20(18)22)16-6-9-28(10-7-16)19-11-17-3-1-2-4-21(17)26-14-19/h1-5,8,11-16H,6-7,9-10H2,(H,27,29).
What are the key properties of N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide?
N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,7-naphthyridin-4-yl)-1-quinolin-3-ylpiperidine-4-carboxamide is sourced from PubChem (CID 58653171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).