N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide

C17H21N5O2 — CID 90426874

IUPACN-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide
SMILESCN(C(=O)C1CCNCC1)c1cc(Oc2ccc(N)nc2)ccn1
InChIInChI=1S/C17H21N5O2/c1-22(17(23)12-4-7-19-8-5-12)16-10-13(6-9-20-16)24-14-2-3-15(18)21-11-14/h2-3,6,9-12,19H,4-5,7-8H2,1H3,(H2,18,21)
InChIKeyQHFKEEVZURFINH-UHFFFAOYSA-N
MW327.39 g/mol
LogP1.81
Rot. Bonds4

About N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide

N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide (PubChem CID 90426874) has the molecular formula C17H21N5O2 and a molecular weight of 327.39 g/mol. Its IUPAC name is N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide
PubChem CID90426874
Molecular FormulaC17H21N5O2
Molecular Weight327.39 g/mol
Exact Mass327.17
IUPAC NameN-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide
SMILESCN(C(=O)C1CCNCC1)c1cc(Oc2ccc(N)nc2)ccn1
InChIInChI=1S/C17H21N5O2/c1-22(17(23)12-4-7-19-8-5-12)16-10-13(6-9-20-16)24-14-2-3-15(18)21-11-14/h2-3,6,9-12,19H,4-5,7-8H2,1H3,(H2,18,21)
InChIKeyQHFKEEVZURFINH-UHFFFAOYSA-N
XLogP1.81
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide?
The IUPAC name of N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide (CID 90426874) is N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide?
The canonical SMILES for N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide is CN(C(=O)C1CCNCC1)c1cc(Oc2ccc(N)nc2)ccn1.
What is the InChIKey of N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide?
The InChIKey is QHFKEEVZURFINH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O2/c1-22(17(23)12-4-7-19-8-5-12)16-10-13(6-9-20-16)24-14-2-3-15(18)21-11-14/h2-3,6,9-12,19H,4-5,7-8H2,1H3,(H2,18,21).
What are the key properties of N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide?
N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide has a molecular weight of 327.39 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(6-amino-3-pyridinyl)oxy]-2-pyridinyl]-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 90426874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).