N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide

C24H32N2O3 — CID 12741855

IUPACN-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
SMILESCCC(=O)N(c1ccc(OC)cc1OC)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C24H32N2O3/c1-4-24(27)26(22-11-10-21(28-2)18-23(22)29-3)20-13-16-25(17-14-20)15-12-19-8-6-5-7-9-19/h5-11,18,20H,4,12-17H2,1-3H3
InChIKeyPCZNDEKFXIUGEN-UHFFFAOYSA-N
MW396.53 g/mol
LogP4.15
Rot. Bonds8

About N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide

N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide (PubChem CID 12741855) has the molecular formula C24H32N2O3 and a molecular weight of 396.53 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
PubChem CID12741855
Molecular FormulaC24H32N2O3
Molecular Weight396.53 g/mol
Exact Mass396.24
IUPAC NameN-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
SMILESCCC(=O)N(c1ccc(OC)cc1OC)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C24H32N2O3/c1-4-24(27)26(22-11-10-21(28-2)18-23(22)29-3)20-13-16-25(17-14-20)15-12-19-8-6-5-7-9-19/h5-11,18,20H,4,12-17H2,1-3H3
InChIKeyPCZNDEKFXIUGEN-UHFFFAOYSA-N
XLogP4.15
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.53
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide (CID 12741855) is N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide is CCC(=O)N(c1ccc(OC)cc1OC)C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
The InChIKey is PCZNDEKFXIUGEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O3/c1-4-24(27)26(22-11-10-21(28-2)18-23(22)29-3)20-13-16-25(17-14-20)15-12-19-8-6-5-7-9-19/h5-11,18,20H,4,12-17H2,1-3H3.
What are the key properties of N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide has a molecular weight of 396.53 g/mol, XLogP of 4.15, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 12741855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).