N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide

C24H32N2O — CID 59101556

IUPACN-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide
SMILESCCC(=O)N(C[C@@H]1CCCN(CC(C)c2ccccc2)C1)c1ccccc1
InChIInChI=1S/C24H32N2O/c1-3-24(27)26(23-14-8-5-9-15-23)19-21-11-10-16-25(18-21)17-20(2)22-12-6-4-7-13-22/h4-9,12-15,20-21H,3,10-11,16-19H2,1-2H3/t20?,21-/m1/s1
InChIKeyMMRURGUGRGRQQR-BPGUCPLFSA-N
MW364.53 g/mol
LogP4.95
Rot. Bonds7

About N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide

N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide (PubChem CID 59101556) has the molecular formula C24H32N2O and a molecular weight of 364.53 g/mol. Its IUPAC name is N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide.

Molecular Properties

Compound NameN-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide
PubChem CID59101556
Molecular FormulaC24H32N2O
Molecular Weight364.53 g/mol
Exact Mass364.25
IUPAC NameN-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide
SMILESCCC(=O)N(C[C@@H]1CCCN(CC(C)c2ccccc2)C1)c1ccccc1
InChIInChI=1S/C24H32N2O/c1-3-24(27)26(23-14-8-5-9-15-23)19-21-11-10-16-25(18-21)17-20(2)22-12-6-4-7-13-22/h4-9,12-15,20-21H,3,10-11,16-19H2,1-2H3/t20?,21-/m1/s1
InChIKeyMMRURGUGRGRQQR-BPGUCPLFSA-N
XLogP4.95
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.53
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[1-phenyl-2-[3-[(N-propanoylanilino)methyl]piperidin-1-yl]ethyl] propanoate
CID 20598068
N-phenyl-N-[[1-[(2Z)-2-sulfanylpenta-2,4-dienyl]azepan-3-yl]methyl]propanamide
CID 142099231
[(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol
CID 129425520
N-phenyl-N-[[1-[(2-phenylethylamino)methyl]azepan-3-yl]methyl]propanamide
CID 57086462
N-[[1-(2-phenylpropyl)piperidin-3-yl]methyl]propan-2-amine
CID 63240509
benzyl 3-[(N-propanoylanilino)methyl]azepane-1-carboxylate
CID 20598087
N-(1-phenylethyl)-N-[[1-(2-phenylethyl)piperidin-3-yl]methyl]propanamide
CID 161150903
N-[(1R)-1-phenylethyl]-N-[[1-(2-phenylethyl)piperidin-3-yl]methyl]propanamide
CID 10271032
N-[(1R)-1-[(3R)-1-[(2S)-2-hydroxy-2-phenylethyl]piperidin-3-yl]ethyl]-N-phenylpropanamide
CID 10199807
N-methyl-1-(2-phenylpropyl)piperidin-3-amine
CID 55086340
(3R)-1-[(2S)-2-phenylpropyl]pyrrolidine-3-carboxylic acid
CID 129413679
N-but-1-en-2-yl-N-[[1-(2-phenylethyl)piperidin-3-yl]methyl]aniline
CID 142167405

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide?
The IUPAC name of N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide (CID 59101556) is N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide.
What is the SMILES notation for N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide?
The canonical SMILES for N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide is CCC(=O)N(C[C@@H]1CCCN(CC(C)c2ccccc2)C1)c1ccccc1.
What is the InChIKey of N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide?
The InChIKey is MMRURGUGRGRQQR-BPGUCPLFSA-N. The full InChI is InChI=1S/C24H32N2O/c1-3-24(27)26(23-14-8-5-9-15-23)19-21-11-10-16-25(18-21)17-20(2)22-12-6-4-7-13-22/h4-9,12-15,20-21H,3,10-11,16-19H2,1-2H3/t20?,21-/m1/s1.
What are the key properties of N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide?
N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide has a molecular weight of 364.53 g/mol, XLogP of 4.95, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide is sourced from PubChem (CID 59101556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).