N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide

C18H21N3O2 — CID 90566130

IUPACN-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide
SMILESO=C(NCc1ccccc1)N1CCC(Oc2cccnc2)CC1
InChIInChI=1S/C18H21N3O2/c22-18(20-13-15-5-2-1-3-6-15)21-11-8-16(9-12-21)23-17-7-4-10-19-14-17/h1-7,10,14,16H,8-9,11-13H2,(H,20,22)
InChIKeyDMOWXECHQDQLEJ-UHFFFAOYSA-N
MW311.38 g/mol
LogP2.83
Rot. Bonds4

About N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide

N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide (PubChem CID 90566130) has the molecular formula C18H21N3O2 and a molecular weight of 311.38 g/mol. Its IUPAC name is N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide
PubChem CID90566130
Molecular FormulaC18H21N3O2
Molecular Weight311.38 g/mol
Exact Mass311.16
IUPAC NameN-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide
SMILESO=C(NCc1ccccc1)N1CCC(Oc2cccnc2)CC1
InChIInChI=1S/C18H21N3O2/c22-18(20-13-15-5-2-1-3-6-15)21-11-8-16(9-12-21)23-17-7-4-10-19-14-17/h1-7,10,14,16H,8-9,11-13H2,(H,20,22)
InChIKeyDMOWXECHQDQLEJ-UHFFFAOYSA-N
XLogP2.83
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexen-1-ylmethyl)-4-pyridin-3-yloxypiperidine-1-carboxamide
CID 122562954
4-N-benzyl-1-N-(pyridin-3-ylmethyl)piperidine-1,4-dicarboxamide
CID 86911861
[6-(benzylamino)-3-pyridinyl]-(4-pyridin-3-yloxypiperidin-1-yl)methanone
CID 28766355
4-phenyl-1-(4-pyridin-3-yloxypiperidin-1-yl)butan-1-one
CID 71801294
N-[1-(benzylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47836760
[(1R,2R)-2-phenylcyclopropyl]-(4-pyridin-3-yloxypiperidin-1-yl)methanone
CID 56643265
N-benzyl-3-methoxypyrrolidine-1-carboxamide
CID 107653241
N-benzyl-3-(6-methoxypyrazin-2-yl)oxypyrrolidine-1-carboxamide
CID 90637578
N-[(4-fluorophenyl)methyl]-4-(2-pyridin-3-yloxyethyl)piperidine-1-carboxamide
CID 53151043
N-benzyl-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide
CID 1446435
N-benzyl-4-methylpiperidine-1-carboxamide
CID 18715459
N-benzyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
CID 53150970

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide?
The IUPAC name of N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide (CID 90566130) is N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide.
What is the SMILES notation for N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide?
The canonical SMILES for N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide is O=C(NCc1ccccc1)N1CCC(Oc2cccnc2)CC1.
What is the InChIKey of N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide?
The InChIKey is DMOWXECHQDQLEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c22-18(20-13-15-5-2-1-3-6-15)21-11-8-16(9-12-21)23-17-7-4-10-19-14-17/h1-7,10,14,16H,8-9,11-13H2,(H,20,22).
What are the key properties of N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide?
N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide has a molecular weight of 311.38 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-pyridin-3-yloxypiperidine-1-carboxamide is sourced from PubChem (CID 90566130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).