N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide

C22H26N2O3 — CID 155248716

IUPACN-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide
SMILESCOc1ccccc1N(C=O)C1CCN(C(=O)Cc2ccc(C)cc2)CC1
InChIInChI=1S/C22H26N2O3/c1-17-7-9-18(10-8-17)15-22(26)23-13-11-19(12-14-23)24(16-25)20-5-3-4-6-21(20)27-2/h3-10,16,19H,11-15H2,1-2H3
InChIKeyROVVTGZAPBWCMT-UHFFFAOYSA-N
MW366.46 g/mol
LogP3.20
Rot. Bonds6

About N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide

N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide (PubChem CID 155248716) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide
PubChem CID155248716
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC NameN-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide
SMILESCOc1ccccc1N(C=O)C1CCN(C(=O)Cc2ccc(C)cc2)CC1
InChIInChI=1S/C22H26N2O3/c1-17-7-9-18(10-8-17)15-22(26)23-13-11-19(12-14-23)24(16-25)20-5-3-4-6-21(20)27-2/h3-10,16,19H,11-15H2,1-2H3
InChIKeyROVVTGZAPBWCMT-UHFFFAOYSA-N
XLogP3.20
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]-N-[2-(methylamino)phenyl]formamide
CID 170145483
1-[4-[2-(2-methoxyphenyl)acetyl]piperazin-1-yl]-2-(4-methylphenyl)ethanone
CID 110818906
N-(2-methoxyphenyl)-1-[2-(4-methylphenyl)acetyl]piperidine-4-carboxamide
CID 38645839
N-[1-[2-(4-chlorophenyl)acetyl]piperidin-4-yl]-2-methoxybenzamide
CID 108559283
1-(4-bromopiperidin-1-yl)-2-(2-methoxyphenyl)ethanone
CID 80661576
1-[4-(dimethylamino)piperidin-1-yl]-2-(4-methoxyphenyl)ethanone
CID 110866811
1-[4-(chloromethyl)piperidin-1-yl]-2-(4-methylphenyl)ethanone
CID 63397980
2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide
CID 120668110
1-[2-(4-methylphenyl)acetyl]-N-phenylpiperidine-4-carboxamide
CID 26462642
N-(2-methoxyphenyl)-1-[2-(4-methoxyphenyl)acetyl]piperidine-4-carboxamide
CID 33344202
N-[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide
CID 108556941
2-(4-fluorophenyl)-1-[4-(3-methoxy-2-methylbenzoyl)piperidin-1-yl]ethanone
CID 142039589

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide?
The IUPAC name of N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide (CID 155248716) is N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide.
What is the SMILES notation for N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide?
The canonical SMILES for N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide is COc1ccccc1N(C=O)C1CCN(C(=O)Cc2ccc(C)cc2)CC1.
What is the InChIKey of N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide?
The InChIKey is ROVVTGZAPBWCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-17-7-9-18(10-8-17)15-22(26)23-13-11-19(12-14-23)24(16-25)20-5-3-4-6-21(20)27-2/h3-10,16,19H,11-15H2,1-2H3.
What are the key properties of N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide?
N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide has a molecular weight of 366.46 g/mol, XLogP of 3.20, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-N-[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]formamide is sourced from PubChem (CID 155248716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).