N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide

C23H29N3O2 — CID 92601905

IUPACN-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide
SMILESCc1cc(Oc2ccc(NC(=O)C3CCCC3)cc2)cc(C2CCNCC2)n1
InChIInChI=1S/C23H29N3O2/c1-16-14-21(15-22(25-16)17-10-12-24-13-11-17)28-20-8-6-19(7-9-20)26-23(27)18-4-2-3-5-18/h6-9,14-15,17-18,24H,2-5,10-13H2,1H3,(H,26,27)
InChIKeyMWRBLANTFKPVNA-UHFFFAOYSA-N
MW379.50 g/mol
LogP4.78
Rot. Bonds5

About N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide

N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide (PubChem CID 92601905) has the molecular formula C23H29N3O2 and a molecular weight of 379.50 g/mol. Its IUPAC name is N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide
PubChem CID92601905
Molecular FormulaC23H29N3O2
Molecular Weight379.50 g/mol
Exact Mass379.23
IUPAC NameN-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide
SMILESCc1cc(Oc2ccc(NC(=O)C3CCCC3)cc2)cc(C2CCNCC2)n1
InChIInChI=1S/C23H29N3O2/c1-16-14-21(15-22(25-16)17-10-12-24-13-11-17)28-20-8-6-19(7-9-20)26-23(27)18-4-2-3-5-18/h6-9,14-15,17-18,24H,2-5,10-13H2,1H3,(H,26,27)
InChIKeyMWRBLANTFKPVNA-UHFFFAOYSA-N
XLogP4.78
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide?
The IUPAC name of N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide (CID 92601905) is N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide?
The canonical SMILES for N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide is Cc1cc(Oc2ccc(NC(=O)C3CCCC3)cc2)cc(C2CCNCC2)n1.
What is the InChIKey of N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide?
The InChIKey is MWRBLANTFKPVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O2/c1-16-14-21(15-22(25-16)17-10-12-24-13-11-17)28-20-8-6-19(7-9-20)26-23(27)18-4-2-3-5-18/h6-9,14-15,17-18,24H,2-5,10-13H2,1H3,(H,26,27).
What are the key properties of N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide?
N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide has a molecular weight of 379.50 g/mol, XLogP of 4.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]cyclopentanecarboxamide is sourced from PubChem (CID 92601905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).