N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide

C18H26N2O3 — CID 91768208

IUPACN-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide
SMILESO=C(CN1CCC(c2ccccc2)CC1)N[C@@H]1COCC[C@H]1O
InChIInChI=1S/C18H26N2O3/c21-17-8-11-23-13-16(17)19-18(22)12-20-9-6-15(7-10-20)14-4-2-1-3-5-14/h1-5,15-17,21H,6-13H2,(H,19,22)/t16-,17-/m1/s1
InChIKeyKKQNMGFDSISDMG-IAGOWNOFSA-N
MW318.42 g/mol
LogP1.13
Rot. Bonds4

About N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide

N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide (PubChem CID 91768208) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide
PubChem CID91768208
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC NameN-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide
SMILESO=C(CN1CCC(c2ccccc2)CC1)N[C@@H]1COCC[C@H]1O
InChIInChI=1S/C18H26N2O3/c21-17-8-11-23-13-16(17)19-18(22)12-20-9-6-15(7-10-20)14-4-2-1-3-5-14/h1-5,15-17,21H,6-13H2,(H,19,22)/t16-,17-/m1/s1
InChIKeyKKQNMGFDSISDMG-IAGOWNOFSA-N
XLogP1.13
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 ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide 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-[(3S,4R)-3-ethoxyoxan-4-yl]-2-(4-phenylpiperidin-1-yl)acetamide
CID 91776740
N-(4-hydroxyphenyl)-2-(4-phenylpiperidin-1-yl)acetamide
CID 47021714
N-[(3S,4R)-3-phenylmethoxyoxan-4-yl]-2-piperidin-1-ylacetamide
CID 91786681
2-(4-phenylpiperidin-1-yl)-N-propylacetamide
CID 134001849
N-[(3R,4R)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide
CID 133266894
N-[(3S,4R)-3-hydroxyoxan-4-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide
CID 91767847
2-[4-(4-hydroxyphenyl)piperidin-1-yl]-N-[(1R,2S)-2-methylcyclohexyl]acetamide
CID 94595136
N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(3-methyl-2-oxo-4H-quinazolin-1-yl)acetamide
CID 91759909
N-(2-hydroxyethyl)-2-(3-phenylpyrrolidin-1-yl)acetamide
CID 62133590
methyl 1-[[2-(4-phenylpiperidin-1-yl)acetyl]amino]-2,3,3a,4,5,6,7,7a-octahydro-1H-indene-2-carboxylate
CID 162272059
1-phenoxy-3-(4-phenylpiperidin-1-yl)propan-2-one
CID 71325657
2-(4-phenylpiperidin-1-yl)-1-piperidin-4-ylethanone
CID 67794190

Frequently Asked Questions

What is the IUPAC name of N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide?
The IUPAC name of N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide (CID 91768208) is N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide?
The canonical SMILES for N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide is O=C(CN1CCC(c2ccccc2)CC1)N[C@@H]1COCC[C@H]1O.
What is the InChIKey of N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide?
The InChIKey is KKQNMGFDSISDMG-IAGOWNOFSA-N. The full InChI is InChI=1S/C18H26N2O3/c21-17-8-11-23-13-16(17)19-18(22)12-20-9-6-15(7-10-20)14-4-2-1-3-5-14/h1-5,15-17,21H,6-13H2,(H,19,22)/t16-,17-/m1/s1.
What are the key properties of N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide?
N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide has a molecular weight of 318.42 g/mol, XLogP of 1.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R,4R)-4-hydroxyoxan-3-yl]-2-(4-phenylpiperidin-1-yl)acetamide is sourced from PubChem (CID 91768208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).