5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide

C22H22N4O2 — CID 109103274

IUPAC5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide
SMILESCC1CCN(C(=O)c2cncc(C(=O)Nc3cccc4cccnc34)c2)CC1
InChIInChI=1S/C22H22N4O2/c1-15-7-10-26(11-8-15)22(28)18-12-17(13-23-14-18)21(27)25-19-6-2-4-16-5-3-9-24-20(16)19/h2-6,9,12-15H,7-8,10-11H2,1H3,(H,25,27)
InChIKeyKVXRSTPKESXHFZ-UHFFFAOYSA-N
MW374.44 g/mol
LogP3.75
Rot. Bonds3

About 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide

5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide (PubChem CID 109103274) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide
PubChem CID109103274
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC Name5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide
SMILESCC1CCN(C(=O)c2cncc(C(=O)Nc3cccc4cccnc34)c2)CC1
InChIInChI=1S/C22H22N4O2/c1-15-7-10-26(11-8-15)22(28)18-12-17(13-23-14-18)21(27)25-19-6-2-4-16-5-3-9-24-20(16)19/h2-6,9,12-15H,7-8,10-11H2,1H3,(H,25,27)
InChIKeyKVXRSTPKESXHFZ-UHFFFAOYSA-N
XLogP3.75
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109104633
N-(4-acetamidophenyl)-5-(4-methylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109103264
5-(azepan-1-yl)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109241399
5-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 837055
3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109108883
3-(4-formylpiperazine-1-carbonyl)-N-quinolin-8-ylbenzamide
CID 109053846
3-N-(3,4-dimethylphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109108326
N-(3-methoxyphenyl)-5-(4-methylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109103248
N-(4-chlorophenyl)-5-(4-methylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109103238
5-(4-ethylpiperazin-1-yl)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109230694
N-(3,4-dichlorophenyl)-5-(4-methylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109103278
5-N-(1-phenylethyl)-3-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109105406

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide?
The IUPAC name of 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide (CID 109103274) is 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide.
What is the SMILES notation for 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide?
The canonical SMILES for 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide is CC1CCN(C(=O)c2cncc(C(=O)Nc3cccc4cccnc34)c2)CC1.
What is the InChIKey of 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide?
The InChIKey is KVXRSTPKESXHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-15-7-10-26(11-8-15)22(28)18-12-17(13-23-14-18)21(27)25-19-6-2-4-16-5-3-9-24-20(16)19/h2-6,9,12-15H,7-8,10-11H2,1H3,(H,25,27).
What are the key properties of 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide?
5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperidine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide is sourced from PubChem (CID 109103274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).