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

C20H21N5O2 — CID 167774517

IUPACN-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide
SMILESCN1CCC(Oc2cc(NC(=O)c3cnnc4ccccc34)ccn2)CC1
InChIInChI=1S/C20H21N5O2/c1-25-10-7-15(8-11-25)27-19-12-14(6-9-21-19)23-20(26)17-13-22-24-18-5-3-2-4-16(17)18/h2-6,9,12-13,15H,7-8,10-11H2,1H3,(H,21,23,26)
InChIKeyCIRREHMNKLAOQC-UHFFFAOYSA-N
MW363.42 g/mol
LogP2.75
Rot. Bonds4

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

N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide (PubChem CID 167774517) has the molecular formula C20H21N5O2 and a molecular weight of 363.42 g/mol. Its IUPAC name is N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide.

Molecular Properties

Compound NameN-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide
PubChem CID167774517
Molecular FormulaC20H21N5O2
Molecular Weight363.42 g/mol
Exact Mass363.17
IUPAC NameN-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide
SMILESCN1CCC(Oc2cc(NC(=O)c3cnnc4ccccc34)ccn2)CC1
InChIInChI=1S/C20H21N5O2/c1-25-10-7-15(8-11-25)27-19-12-14(6-9-21-19)23-20(26)17-13-22-24-18-5-3-2-4-16(17)18/h2-6,9,12-13,15H,7-8,10-11H2,1H3,(H,21,23,26)
InChIKeyCIRREHMNKLAOQC-UHFFFAOYSA-N
XLogP2.75
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-4-carboxamide
CID 167934524
N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]quinoline-5-carboxamide
CID 166209151
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-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382515
N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382362
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
[4-(4-chlorophenoxy)piperidin-1-yl]-cinnolin-4-ylmethanone
CID 67168153
N-[4-[4-(1-methylpiperidin-4-yl)oxyphenyl]phenyl]naphthalene-1-carboxamide
CID 118063788
[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methanamine;hydrochloride
CID 159598247

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide?
The IUPAC name of N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide (CID 167774517) is N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide.
What is the SMILES notation for N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide?
The canonical SMILES for N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide is CN1CCC(Oc2cc(NC(=O)c3cnnc4ccccc34)ccn2)CC1.
What is the InChIKey of N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide?
The InChIKey is CIRREHMNKLAOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O2/c1-25-10-7-15(8-11-25)27-19-12-14(6-9-21-19)23-20(26)17-13-22-24-18-5-3-2-4-16(17)18/h2-6,9,12-13,15H,7-8,10-11H2,1H3,(H,21,23,26).
What are the key properties of N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide?
N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide has a molecular weight of 363.42 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]cinnoline-4-carboxamide is sourced from PubChem (CID 167774517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).