2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide

C18H26N2O3 — CID 125446924

IUPAC2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide
SMILESO=C(CN1CCC[C@@H](O)C1)NC1(c2ccccc2)CCOCC1
InChIInChI=1S/C18H26N2O3/c21-16-7-4-10-20(13-16)14-17(22)19-18(8-11-23-12-9-18)15-5-2-1-3-6-15/h1-3,5-6,16,21H,4,7-14H2,(H,19,22)/t16-/m1/s1
InChIKeyMNKOHZRDEAKBEE-MRXNPFEDSA-N
MW318.42 g/mol
LogP1.27
Rot. Bonds4

About 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide

2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide (PubChem CID 125446924) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide.

Molecular Properties

Compound Name2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide
PubChem CID125446924
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide
SMILESO=C(CN1CCC[C@@H](O)C1)NC1(c2ccccc2)CCOCC1
InChIInChI=1S/C18H26N2O3/c21-16-7-4-10-20(13-16)14-17(22)19-18(8-11-23-12-9-18)15-5-2-1-3-6-15/h1-3,5-6,16,21H,4,7-14H2,(H,19,22)/t16-/m1/s1
InChIKeyMNKOHZRDEAKBEE-MRXNPFEDSA-N
XLogP1.27
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-hydroxypiperidin-1-yl)-N-[(1-phenylcyclobutyl)methyl]acetamide
CID 134038296
1-[2-oxo-2-[(1-phenylcyclobutyl)amino]ethyl]piperidine-4-carboxylic acid
CID 119907979
2-[(3S)-oxolan-3-yl]-N-(4-phenyloxan-4-yl)acetamide
CID 125440939
2-(3-hydroxypiperidin-1-yl)-N-(oxan-4-yl)acetamide
CID 63097682
2-[(3S)-3-hydroxypyrrolidin-1-yl]-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 111123150
(2R)-1-[2-oxo-2-[(1-phenylcyclobutyl)amino]ethyl]pyrrolidine-2-carboxylic acid
CID 119914227
N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide
CID 19846169
N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide
CID 47104633
N-(1-cyanocyclohexyl)-2-[(3S)-3-hydroxypiperidin-1-yl]acetamide
CID 51980802
N-(furan-2-ylmethyl)-2-[(3R)-3-hydroxypiperidin-1-yl]acetamide
CID 29231189
N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-ylacetamide
CID 110444239
N'-[2-(3-hydroxypyrrolidin-1-yl)acetyl]benzohydrazide
CID 62916316

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide?
The IUPAC name of 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide (CID 125446924) is 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide.
What is the SMILES notation for 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide?
The canonical SMILES for 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide is O=C(CN1CCC[C@@H](O)C1)NC1(c2ccccc2)CCOCC1.
What is the InChIKey of 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide?
The InChIKey is MNKOHZRDEAKBEE-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H26N2O3/c21-16-7-4-10-20(13-16)14-17(22)19-18(8-11-23-12-9-18)15-5-2-1-3-6-15/h1-3,5-6,16,21H,4,7-14H2,(H,19,22)/t16-/m1/s1.
What are the key properties of 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide?
2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide has a molecular weight of 318.42 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide is sourced from PubChem (CID 125446924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).