N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide

C21H22N4O2 — CID 167934524

IUPACN-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide
SMILESCN1CCC(Oc2cc(NC(=O)c3ccnc4ccccc34)ccn2)CC1
InChIInChI=1S/C21H22N4O2/c1-25-12-8-16(9-13-25)27-20-14-15(6-10-23-20)24-21(26)18-7-11-22-19-5-3-2-4-17(18)19/h2-7,10-11,14,16H,8-9,12-13H2,1H3,(H,23,24,26)
InChIKeyFVFPFVONDMPAGZ-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.36
Rot. Bonds4

About N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide

N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide (PubChem CID 167934524) has the molecular formula C21H22N4O2 and a molecular weight of 362.43 g/mol. Its IUPAC name is N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide.

Molecular Properties

Compound NameN-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide
PubChem CID167934524
Molecular FormulaC21H22N4O2
Molecular Weight362.43 g/mol
Exact Mass362.17
IUPAC NameN-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide
SMILESCN1CCC(Oc2cc(NC(=O)c3ccnc4ccccc34)ccn2)CC1
InChIInChI=1S/C21H22N4O2/c1-25-12-8-16(9-13-25)27-20-14-15(6-10-23-20)24-21(26)18-7-11-22-19-5-3-2-4-17(18)19/h2-7,10-11,14,16H,8-9,12-13H2,1H3,(H,23,24,26)
InChIKeyFVFPFVONDMPAGZ-UHFFFAOYSA-N
XLogP3.36
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-5-carboxamide
CID 166209151
N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide
CID 167774517
N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]-2,3-dihydro-1-benzofuran-4-carboxamide
CID 167877793
N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride
CID 66688370
N-[2-(azetidin-3-yloxy)-4-pyridinyl]-2-methylbenzamide
CID 167912431
N-(4-bromo-3-methylphenyl)quinoline-4-carboxamide
CID 78911729
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)quinoline-4-carboxamide
CID 134024983
N-[4-methyl-3-[[2-(1-methylpiperidin-4-yl)oxypyrimidin-4-yl]amino]phenyl]dibenzofuran-4-carboxamide
CID 22594109
N-[4-methyl-3-[[2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-5-yl]carbamoyl]phenyl]quinoline-4-carboxamide
CID 59381895
N-[4-[4-(1-methylpiperidin-4-yl)oxyphenyl]phenyl]naphthalene-1-carboxamide
CID 118063788
5-(1-methylpiperidin-4-yl)oxy-N-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine-3-carboxamide
CID 10286832
2-[[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methylamino]-N-[4-(1,1,2,2,2-pentafluoroethyl)phenyl]pyridine-3-carboxamide
CID 22249252

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide?
The IUPAC name of N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide (CID 167934524) is N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide.
What is the SMILES notation for N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide?
The canonical SMILES for N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide is CN1CCC(Oc2cc(NC(=O)c3ccnc4ccccc34)ccn2)CC1.
What is the InChIKey of N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide?
The InChIKey is FVFPFVONDMPAGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O2/c1-25-12-8-16(9-13-25)27-20-14-15(6-10-23-20)24-21(26)18-7-11-22-19-5-3-2-4-17(18)19/h2-7,10-11,14,16H,8-9,12-13H2,1H3,(H,23,24,26).
What are the key properties of N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide?
N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide has a molecular weight of 362.43 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide is sourced from PubChem (CID 167934524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).