4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide

C20H24N2O2 — CID 134712464

IUPAC4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide
SMILESO=C(CCCc1ccccc1)N[C@@H]1COC[C@H]1Cc1ccncc1
InChIInChI=1S/C20H24N2O2/c23-20(8-4-7-16-5-2-1-3-6-16)22-19-15-24-14-18(19)13-17-9-11-21-12-10-17/h1-3,5-6,9-12,18-19H,4,7-8,13-15H2,(H,22,23)/t18-,19-/m1/s1
InChIKeySOIROUZCSKXXLI-RTBURBONSA-N
MW324.42 g/mol
LogP2.78
Rot. Bonds7

About 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide

4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide (PubChem CID 134712464) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide.

Molecular Properties

Compound Name4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide
PubChem CID134712464
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide
SMILESO=C(CCCc1ccccc1)N[C@@H]1COC[C@H]1Cc1ccncc1
InChIInChI=1S/C20H24N2O2/c23-20(8-4-7-16-5-2-1-3-6-16)22-19-15-24-14-18(19)13-17-9-11-21-12-10-17/h1-3,5-6,9-12,18-19H,4,7-8,13-15H2,(H,22,23)/t18-,19-/m1/s1
InChIKeySOIROUZCSKXXLI-RTBURBONSA-N
XLogP2.78
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide 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

4-(4-fluorophenyl)-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide
CID 134712334
4-amino-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide;dihydrochloride
CID 154918726
4-methyl-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]pentanamide
CID 134697099
3-methylsulfonyl-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]propanamide
CID 135100569
3-ethoxy-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]propanamide
CID 134712034
N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-4-phenylbutanamide
CID 135113863
2-pyrazol-1-yl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]acetamide
CID 134699637
2-cyclopentyl-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]acetamide
CID 135101855
3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]propanamide
CID 135117287
N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-2,3-dihydro-1H-indene-2-carboxamide
CID 134695488
2-(2-methoxyphenoxy)-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]acetamide
CID 135094569
2-(4-methoxyphenyl)-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]acetamide
CID 134697379

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide?
The IUPAC name of 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide (CID 134712464) is 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide.
What is the SMILES notation for 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide?
The canonical SMILES for 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide is O=C(CCCc1ccccc1)N[C@@H]1COC[C@H]1Cc1ccncc1.
What is the InChIKey of 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide?
The InChIKey is SOIROUZCSKXXLI-RTBURBONSA-N. The full InChI is InChI=1S/C20H24N2O2/c23-20(8-4-7-16-5-2-1-3-6-16)22-19-15-24-14-18(19)13-17-9-11-21-12-10-17/h1-3,5-6,9-12,18-19H,4,7-8,13-15H2,(H,22,23)/t18-,19-/m1/s1.
What are the key properties of 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide?
4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide has a molecular weight of 324.42 g/mol, XLogP of 2.78, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]butanamide is sourced from PubChem (CID 134712464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).