(3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide

C16H24N4O3 — CID 94028864

IUPAC(3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide
SMILESCC(C)Oc1ncccc1CNC(=O)[C@@H]1CCCN(C(N)=O)C1
InChIInChI=1S/C16H24N4O3/c1-11(2)23-15-12(5-3-7-18-15)9-19-14(21)13-6-4-8-20(10-13)16(17)22/h3,5,7,11,13H,4,6,8-10H2,1-2H3,(H2,17,22)(H,19,21)/t13-/m1/s1
InChIKeyGODVZYNBWOFDFK-CYBMUJFWSA-N
MW320.39 g/mol
LogP1.28
Rot. Bonds5

About (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide

(3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide (PubChem CID 94028864) has the molecular formula C16H24N4O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name(3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide
PubChem CID94028864
Molecular FormulaC16H24N4O3
Molecular Weight320.39 g/mol
Exact Mass320.18
IUPAC Name(3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide
SMILESCC(C)Oc1ncccc1CNC(=O)[C@@H]1CCCN(C(N)=O)C1
InChIInChI=1S/C16H24N4O3/c1-11(2)23-15-12(5-3-7-18-15)9-19-14(21)13-6-4-8-20(10-13)16(17)22/h3,5,7,11,13H,4,6,8-10H2,1-2H3,(H2,17,22)(H,19,21)/t13-/m1/s1
InChIKeyGODVZYNBWOFDFK-CYBMUJFWSA-N
XLogP1.28
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide with MolForge

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Related Compounds

rac-(1R,5S,6R)-N-{2-methyl-1-[(3-methylpyridin-2-yl)oxy]propan-2-yl}-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 86294067
US11045457, Example 110
CID 146401856
US11045457, Example 209
CID 146402430
US11045457, Example 33
CID 146422009
1-[2-(4-methoxyphenyl)ethyl]-6-oxo-N-[2-(3-pyridinyl)ethyl]-3-piperidinecarboxamide
CID 24793122
N-cyclohexyl-6-pentoxypyridine-3-carboxamide
CID 71454767
N-[(1S,2R)-2-phenylcyclopropyl]-4-pyridin-2-yloxypiperidine-1-carboxamide
CID 76332319
6-butoxy-N-cyclohexylpyridine-3-carboxamide
CID 58368244
US10166214, Example 52
CID 117709156
US11045457, Example 91
CID 146401824
US11045457, Example 139
CID 146401826
US11045457, Example 37
CID 146401828

Frequently Asked Questions

What is the IUPAC name of (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide?
The IUPAC name of (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide (CID 94028864) is (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide.
What is the SMILES notation for (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide?
The canonical SMILES for (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide is CC(C)Oc1ncccc1CNC(=O)[C@@H]1CCCN(C(N)=O)C1.
What is the InChIKey of (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide?
The InChIKey is GODVZYNBWOFDFK-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H24N4O3/c1-11(2)23-15-12(5-3-7-18-15)9-19-14(21)13-6-4-8-20(10-13)16(17)22/h3,5,7,11,13H,4,6,8-10H2,1-2H3,(H2,17,22)(H,19,21)/t13-/m1/s1.
What are the key properties of (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide?
(3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide has a molecular weight of 320.39 g/mol, XLogP of 1.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,3-dicarboxamide is sourced from PubChem (CID 94028864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).