N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide

C23H33N3O4 — CID 56514384

IUPACN-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
SMILESO=C(NCC(C1CCOC1)N1CCOCC1)C(c1ccccc1)N1CCCCC1=O
InChIInChI=1S/C23H33N3O4/c27-21-8-4-5-10-26(21)22(18-6-2-1-3-7-18)23(28)24-16-20(19-9-13-30-17-19)25-11-14-29-15-12-25/h1-3,6-7,19-20,22H,4-5,8-17H2,(H,24,28)
InChIKeyRZHPBDUFFBYASK-UHFFFAOYSA-N
MW415.53 g/mol
LogP1.59
Rot. Bonds7

About N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide

N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide (PubChem CID 56514384) has the molecular formula C23H33N3O4 and a molecular weight of 415.53 g/mol. Its IUPAC name is N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
PubChem CID56514384
Molecular FormulaC23H33N3O4
Molecular Weight415.53 g/mol
Exact Mass415.25
IUPAC NameN-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
SMILESO=C(NCC(C1CCOC1)N1CCOCC1)C(c1ccccc1)N1CCCCC1=O
InChIInChI=1S/C23H33N3O4/c27-21-8-4-5-10-26(21)22(18-6-2-1-3-7-18)23(28)24-16-20(19-9-13-30-17-19)25-11-14-29-15-12-25/h1-3,6-7,19-20,22H,4-5,8-17H2,(H,24,28)
InChIKeyRZHPBDUFFBYASK-UHFFFAOYSA-N
XLogP1.59
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.53
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-2-phenylbutanamide
CID 94150246
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56512944
1-[cyclopropyl(phenyl)methyl]-3-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]urea
CID 55590697
N-(cyclopropylmethyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56515214
1-(2-chlorophenyl)-3-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]urea
CID 55696727
(2S)-2-(benzenesulfonamido)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]propanamide
CID 55938397
2-methyl-1-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-3-(2-phenyl-2-pyrrolidin-1-ylethyl)guanidine;hydroiodide
CID 111326635
1-benzyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide
CID 55603184
1-(benzenesulfonyl)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]piperidine-2-carboxamide
CID 55641996
N-(3-cyclopentylpropyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56577591
2-(4-methylphenyl)-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]acetamide
CID 94150138
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94083431

Frequently Asked Questions

What is the IUPAC name of N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide?
The IUPAC name of N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide (CID 56514384) is N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide.
What is the SMILES notation for N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide?
The canonical SMILES for N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide is O=C(NCC(C1CCOC1)N1CCOCC1)C(c1ccccc1)N1CCCCC1=O.
What is the InChIKey of N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide?
The InChIKey is RZHPBDUFFBYASK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33N3O4/c27-21-8-4-5-10-26(21)22(18-6-2-1-3-7-18)23(28)24-16-20(19-9-13-30-17-19)25-11-14-29-15-12-25/h1-3,6-7,19-20,22H,4-5,8-17H2,(H,24,28).
What are the key properties of N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide?
N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide has a molecular weight of 415.53 g/mol, XLogP of 1.59, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide is sourced from PubChem (CID 56514384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).