4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide

C21H27N3O3 — CID 126792921

IUPAC4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide
SMILESCCOC1CCN(C(=O)Nc2ccc(OCCc3ccccc3)nc2)CC1
InChIInChI=1S/C21H27N3O3/c1-2-26-19-10-13-24(14-11-19)21(25)23-18-8-9-20(22-16-18)27-15-12-17-6-4-3-5-7-17/h3-9,16,19H,2,10-15H2,1H3,(H,23,25)
InChIKeyNOVLGCMZISCEGN-UHFFFAOYSA-N
MW369.47 g/mol
LogP3.74
Rot. Bonds7

About 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide

4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide (PubChem CID 126792921) has the molecular formula C21H27N3O3 and a molecular weight of 369.47 g/mol. Its IUPAC name is 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide
PubChem CID126792921
Molecular FormulaC21H27N3O3
Molecular Weight369.47 g/mol
Exact Mass369.21
IUPAC Name4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide
SMILESCCOC1CCN(C(=O)Nc2ccc(OCCc3ccccc3)nc2)CC1
InChIInChI=1S/C21H27N3O3/c1-2-26-19-10-13-24(14-11-19)21(25)23-18-8-9-20(22-16-18)27-15-12-17-6-4-3-5-7-17/h3-9,16,19H,2,10-15H2,1H3,(H,23,25)
InChIKeyNOVLGCMZISCEGN-UHFFFAOYSA-N
XLogP3.74
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-3-(3-phenylpropoxy)-N-pyridin-3-ylpyrrolidine-1-carboxamide
CID 96560292
1-[[3-(2-phenylethoxy)phenyl]carbamoyl]piperidine-4-carboxylic acid
CID 122092864
6-ethoxy-N-[1-(phenylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 87034036
3-(1H-benzimidazol-2-yl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]piperidine-1-carboxamide
CID 47041579
N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-4-phenylmethoxypiperidine-1-carboxamide
CID 118764730
N-(4-ethoxyphenyl)-4-quinoxalin-2-yloxypiperidine-1-carboxamide
CID 90560057
1,1-dimethyl-3-[6-(3-phenylpropoxy)-3-pyridinyl]urea
CID 13023118
N-(1-cyclopropyl-2-phenylethyl)-4-ethoxypiperidine-1-carboxamide
CID 56793712
2-[1-[(6-ethoxy-3-pyridinyl)carbamoyl]azetidin-3-yl]propanoic acid
CID 116683489
N-[6-(2-phenylethoxy)-3-pyridinyl]-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 126789214
4-benzamido-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]piperidine-1-carboxamide
CID 47041270
N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
CID 55743984

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide?
The IUPAC name of 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide (CID 126792921) is 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide?
The canonical SMILES for 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide is CCOC1CCN(C(=O)Nc2ccc(OCCc3ccccc3)nc2)CC1.
What is the InChIKey of 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide?
The InChIKey is NOVLGCMZISCEGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O3/c1-2-26-19-10-13-24(14-11-19)21(25)23-18-8-9-20(22-16-18)27-15-12-17-6-4-3-5-7-17/h3-9,16,19H,2,10-15H2,1H3,(H,23,25).
What are the key properties of 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide?
4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide has a molecular weight of 369.47 g/mol, XLogP of 3.74, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[6-(2-phenylethoxy)-3-pyridinyl]piperidine-1-carboxamide is sourced from PubChem (CID 126792921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).