N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide

C14H19F2N3O2 — CID 99777136

IUPACN-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide
SMILESO=C(NCc1ccnc(OCC(F)F)c1)C1CCNCC1
InChIInChI=1S/C14H19F2N3O2/c15-12(16)9-21-13-7-10(1-6-18-13)8-19-14(20)11-2-4-17-5-3-11/h1,6-7,11-12,17H,2-5,8-9H2,(H,19,20)
InChIKeyLOTNDYIVPKZLSG-UHFFFAOYSA-N
MW299.32 g/mol
LogP1.34
Rot. Bonds6

About N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide

N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide (PubChem CID 99777136) has the molecular formula C14H19F2N3O2 and a molecular weight of 299.32 g/mol. Its IUPAC name is N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide
PubChem CID99777136
Molecular FormulaC14H19F2N3O2
Molecular Weight299.32 g/mol
Exact Mass299.14
IUPAC NameN-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide
SMILESO=C(NCc1ccnc(OCC(F)F)c1)C1CCNCC1
InChIInChI=1S/C14H19F2N3O2/c15-12(16)9-21-13-7-10(1-6-18-13)8-19-14(20)11-2-4-17-5-3-11/h1,6-7,11-12,17H,2-5,8-9H2,(H,19,20)
InChIKeyLOTNDYIVPKZLSG-UHFFFAOYSA-N
XLogP1.34
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.32
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-methoxy-4-pyridinyl)methyl]cyclopropanecarboxamide
CID 60715595
N-[(2-methoxy-4-pyridinyl)methyl]-2-methylpiperidine-4-carboxamide
CID 106739998
N-[(3,4-difluorophenyl)methyl]piperidine-4-carboxamide
CID 54967962
1-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]-3-(6-fluoro-2,3-dihydro-1H-inden-1-yl)urea
CID 171787315
N-[(3-fluoro-4-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 82133842
N-benzylpiperidine-4-carboxamide
CID 3868064
[2-(2,2-difluoroethoxy)-4-pyridinyl]methanol
CID 82007049
3,3-dimethyl-N-[[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]methyl]cyclobutane-1-carboxamide
CID 178036152
N-[[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]methyl]piperidine-2-carboxamide
CID 119847050
N-[(2-methoxy-4-pyridinyl)methyl]-2-piperidin-4-yloxyacetamide
CID 63875211
N-[[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]methyl]spiro[2.3]hexane-5-carboxamide
CID 178036109
N-(1H-pyrazol-4-ylmethyl)piperidine-4-carboxamide
CID 61000741

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide?
The IUPAC name of N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide (CID 99777136) is N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide?
The canonical SMILES for N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide is O=C(NCc1ccnc(OCC(F)F)c1)C1CCNCC1.
What is the InChIKey of N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide?
The InChIKey is LOTNDYIVPKZLSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2N3O2/c15-12(16)9-21-13-7-10(1-6-18-13)8-19-14(20)11-2-4-17-5-3-11/h1,6-7,11-12,17H,2-5,8-9H2,(H,19,20).
What are the key properties of N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide?
N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide has a molecular weight of 299.32 g/mol, XLogP of 1.34, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,2-difluoroethoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide is sourced from PubChem (CID 99777136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).