2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide

C20H27N3O4 — CID 119136022

IUPAC2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide
SMILESNC(=O)COc1ccc(C(=O)N2CCC(CN3CCCCC3=O)CC2)cc1
InChIInChI=1S/C20H27N3O4/c21-18(24)14-27-17-6-4-16(5-7-17)20(26)22-11-8-15(9-12-22)13-23-10-2-1-3-19(23)25/h4-7,15H,1-3,8-14H2,(H2,21,24)
InChIKeyHXPHKVNXSKLRIW-UHFFFAOYSA-N
MW373.45 g/mol
LogP1.42
Rot. Bonds6

About 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide

2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide (PubChem CID 119136022) has the molecular formula C20H27N3O4 and a molecular weight of 373.45 g/mol. Its IUPAC name is 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide
PubChem CID119136022
Molecular FormulaC20H27N3O4
Molecular Weight373.45 g/mol
Exact Mass373.20
IUPAC Name2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide
SMILESNC(=O)COc1ccc(C(=O)N2CCC(CN3CCCCC3=O)CC2)cc1
InChIInChI=1S/C20H27N3O4/c21-18(24)14-27-17-6-4-16(5-7-17)20(26)22-11-8-15(9-12-22)13-23-10-2-1-3-19(23)25/h4-7,15H,1-3,8-14H2,(H2,21,24)
InChIKeyHXPHKVNXSKLRIW-UHFFFAOYSA-N
XLogP1.42
TPSA92.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.45
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[4-(methoxymethyl)piperidine-1-carbonyl]phenoxy]acetamide
CID 119129466
5-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]-1H-pyridin-2-one
CID 126786973
4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]pyridine-2-carboxylic acid
CID 119185875
2-[4-[4-[2-(4-methoxyphenyl)ethyl]piperidine-1-carbonyl]phenoxy]acetamide
CID 17409629
3-[[5-[4-[(2-oxopyrrolidin-1-yl)methyl]piperidine-1-carbonyl]-2-pyridinyl]amino]propanamide
CID 56751758
1-[[1-(2-aminobenzoyl)piperidin-4-yl]methyl]piperidin-2-one
CID 119945615
4-[3-oxo-3-[4-[(2-oxopiperidin-1-yl)methyl]piperidin-1-yl]propyl]benzoic acid
CID 119185876
3-[(2S)-1-[4-(2-amino-2-oxoethoxy)benzoyl]piperidin-2-yl]propanoic acid
CID 125118118
1-[[1-(3-ethylthiophene-2-carbonyl)piperidin-4-yl]methyl]piperidin-2-one
CID 56792637
2-[4-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide
CID 51278709
methyl 1-[4-(2-amino-2-oxoethoxy)benzoyl]piperidine-3-carboxylate
CID 119109496
2-[4-(4-phenylpiperazine-1-carbonyl)phenoxy]acetamide
CID 27671794

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide?
The IUPAC name of 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide (CID 119136022) is 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide.
What is the SMILES notation for 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide?
The canonical SMILES for 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide is NC(=O)COc1ccc(C(=O)N2CCC(CN3CCCCC3=O)CC2)cc1.
What is the InChIKey of 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide?
The InChIKey is HXPHKVNXSKLRIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O4/c21-18(24)14-27-17-6-4-16(5-7-17)20(26)22-11-8-15(9-12-22)13-23-10-2-1-3-19(23)25/h4-7,15H,1-3,8-14H2,(H2,21,24).
What are the key properties of 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide?
2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide has a molecular weight of 373.45 g/mol, XLogP of 1.42, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-[(2-oxopiperidin-1-yl)methyl]piperidine-1-carbonyl]phenoxy]acetamide is sourced from PubChem (CID 119136022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).