N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide

C24H32N2O3 — CID 46054921

IUPACN-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide
SMILESCCCC(=O)N(c1ccc(C)cc1)C1CCN(Cc2ccc(O)c(OC)c2)CC1
InChIInChI=1S/C24H32N2O3/c1-4-5-24(28)26(20-9-6-18(2)7-10-20)21-12-14-25(15-13-21)17-19-8-11-22(27)23(16-19)29-3/h6-11,16,21,27H,4-5,12-15,17H2,1-3H3
InChIKeyFILZISQSFKUIKK-UHFFFAOYSA-N
MW396.53 g/mol
LogP4.51
Rot. Bonds7

About N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide

N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide (PubChem CID 46054921) has the molecular formula C24H32N2O3 and a molecular weight of 396.53 g/mol. Its IUPAC name is N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide.

Molecular Properties

Compound NameN-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide
PubChem CID46054921
Molecular FormulaC24H32N2O3
Molecular Weight396.53 g/mol
Exact Mass396.24
IUPAC NameN-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide
SMILESCCCC(=O)N(c1ccc(C)cc1)C1CCN(Cc2ccc(O)c(OC)c2)CC1
InChIInChI=1S/C24H32N2O3/c1-4-5-24(28)26(20-9-6-18(2)7-10-20)21-12-14-25(15-13-21)17-19-8-11-22(27)23(16-19)29-3/h6-11,16,21,27H,4-5,12-15,17H2,1-3H3
InChIKeyFILZISQSFKUIKK-UHFFFAOYSA-N
XLogP4.51
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.53
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dimethoxyphenyl)-N-[1-[(4-methylphenyl)methyl]piperidin-4-yl]butanamide
CID 42853332
N-(4-methoxyphenyl)-N-[1-[(4-methylphenyl)methyl]piperidin-4-yl]propanamide
CID 42853290
N-(3,4-dimethoxyphenyl)-N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-3-methylbenzamide
CID 46054860
N-(4-ethylphenyl)-N-[1-[(2-hydroxyphenyl)methyl]piperidin-4-yl]butanamide
CID 46054963
N-(3-fluoro-4-methylphenyl)-N-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]butanamide
CID 46048329
2-methoxy-N-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)acetamide
CID 42853361
3-chloro-N-(4-fluorophenyl)-N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]benzamide
CID 46055084
2-methoxy-4-[(4-methylpiperidin-1-yl)methyl]phenol
CID 82974482
N-(4-ethylphenyl)-N-[1-[(3-hydroxy-4-methoxyphenyl)methyl]piperidin-4-yl]-2-methylpropanamide
CID 42858416
N-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-4-yl]-N-(4-fluorophenyl)butanamide
CID 46054472
N-[1-[(3,4-dimethylphenyl)methyl]piperidin-4-yl]-N-(4-ethylphenyl)propanamide
CID 46054953
N-[1-[(3-chlorophenyl)methyl]piperidin-4-yl]-N-(3-methylphenyl)butanamide
CID 46048250

Frequently Asked Questions

What is the IUPAC name of N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide?
The IUPAC name of N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide (CID 46054921) is N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide.
What is the SMILES notation for N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide?
The canonical SMILES for N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide is CCCC(=O)N(c1ccc(C)cc1)C1CCN(Cc2ccc(O)c(OC)c2)CC1.
What is the InChIKey of N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide?
The InChIKey is FILZISQSFKUIKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O3/c1-4-5-24(28)26(20-9-6-18(2)7-10-20)21-12-14-25(15-13-21)17-19-8-11-22(27)23(16-19)29-3/h6-11,16,21,27H,4-5,12-15,17H2,1-3H3.
What are the key properties of N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide?
N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide has a molecular weight of 396.53 g/mol, XLogP of 4.51, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-N-(4-methylphenyl)butanamide is sourced from PubChem (CID 46054921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).