(2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide

C23H24N4O2 — CID 42518595

IUPAC(2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide
SMILESO=C(Nc1ccc(Oc2ccccc2)nc1)[C@@H]1CCCCN1Cc1ccccn1
InChIInChI=1S/C23H24N4O2/c28-23(21-11-5-7-15-27(21)17-19-8-4-6-14-24-19)26-18-12-13-22(25-16-18)29-20-9-2-1-3-10-20/h1-4,6,8-10,12-14,16,21H,5,7,11,15,17H2,(H,26,28)/t21-/m0/s1
InChIKeyQTWORGOSEGXUTH-NRFANRHFSA-N
MW388.47 g/mol
LogP4.26
Rot. Bonds6

About (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide

(2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide (PubChem CID 42518595) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide
PubChem CID42518595
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name(2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide
SMILESO=C(Nc1ccc(Oc2ccccc2)nc1)[C@@H]1CCCCN1Cc1ccccn1
InChIInChI=1S/C23H24N4O2/c28-23(21-11-5-7-15-27(21)17-19-8-4-6-14-24-19)26-18-12-13-22(25-16-18)29-20-9-2-1-3-10-20/h1-4,6,8-10,12-14,16,21H,5,7,11,15,17H2,(H,26,28)/t21-/m0/s1
InChIKeyQTWORGOSEGXUTH-NRFANRHFSA-N
XLogP4.26
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(1-ethylimidazol-2-yl)methyl]-N-(6-phenoxy-3-pyridinyl)piperidine-2-carboxamide
CID 56704411
(2S)-N-(6-phenoxy-3-pyridinyl)-1-[(2-propylpyrimidin-5-yl)methyl]piperidine-2-carboxamide
CID 42198878
(2R)-N-(6-phenoxy-3-pyridinyl)-1-[(1-propan-2-ylpyrazol-4-yl)methyl]piperidine-2-carboxamide
CID 42099019
(2S)-1-[(1-methylbenzimidazol-2-yl)methyl]-N-(6-phenoxy-3-pyridinyl)piperidine-2-carboxamide
CID 25274218
1-[(1-methylbenzimidazol-2-yl)methyl]-N-(6-phenoxy-3-pyridinyl)piperidine-2-carboxamide
CID 45197081
(2S)-1-cyclobutyl-N-(6-phenoxy-3-pyridinyl)piperidine-2-carboxamide
CID 42286968
(2R)-1-(1,2-oxazole-5-carbonyl)-N-(6-phenoxy-3-pyridinyl)piperidine-2-carboxamide
CID 97279481
1-(pyridin-2-ylmethyl)piperidine-2-carboxylic acid
CID 3310789
(2R)-1-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid
CID 40787079
N-(3,4-dichlorophenyl)-1-(pyridin-2-ylmethyl)azetidine-2-carboxamide
CID 172896052
N-phenyl-1-(2-pyridin-2-ylethyl)pyrrolidine-2-carboxamide
CID 47027276
1-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethyl]-3-(6-phenoxy-3-pyridinyl)urea
CID 97454834

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide?
The IUPAC name of (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide (CID 42518595) is (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide?
The canonical SMILES for (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide is O=C(Nc1ccc(Oc2ccccc2)nc1)[C@@H]1CCCCN1Cc1ccccn1.
What is the InChIKey of (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide?
The InChIKey is QTWORGOSEGXUTH-NRFANRHFSA-N. The full InChI is InChI=1S/C23H24N4O2/c28-23(21-11-5-7-15-27(21)17-19-8-4-6-14-24-19)26-18-12-13-22(25-16-18)29-20-9-2-1-3-10-20/h1-4,6,8-10,12-14,16,21H,5,7,11,15,17H2,(H,26,28)/t21-/m0/s1.
What are the key properties of (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide?
(2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 4.26, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(6-phenoxy-3-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-2-carboxamide is sourced from PubChem (CID 42518595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).