N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide

C27H28N2O2 — CID 4939344

IUPACN-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide
SMILESCC1CCN(C(=O)c2ccccc2NC(=O)C(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C27H28N2O2/c1-20-16-18-29(19-17-20)27(31)23-14-8-9-15-24(23)28-26(30)25(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,20,25H,16-19H2,1H3,(H,28,30)
InChIKeyYVZQQAUOUXBIHM-UHFFFAOYSA-N
MW412.53 g/mol
LogP5.33
Rot. Bonds5

About N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide

N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide (PubChem CID 4939344) has the molecular formula C27H28N2O2 and a molecular weight of 412.53 g/mol. Its IUPAC name is N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide
PubChem CID4939344
Molecular FormulaC27H28N2O2
Molecular Weight412.53 g/mol
Exact Mass412.22
IUPAC NameN-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide
SMILESCC1CCN(C(=O)c2ccccc2NC(=O)C(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C27H28N2O2/c1-20-16-18-29(19-17-20)27(31)23-14-8-9-15-24(23)28-26(30)25(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,20,25H,16-19H2,1H3,(H,28,30)
InChIKeyYVZQQAUOUXBIHM-UHFFFAOYSA-N
XLogP5.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.53
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-diphenyl-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 1272938
2,2-diphenyl-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 1341137
[2-(4-methylpiperidine-1-carbonyl)phenyl]thiourea
CID 169356775
4-[[2-(4-methylpiperidine-1-carbonyl)phenyl]carbamoylamino]cyclohexane-1-carboxylic acid
CID 122077257
(2S)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 96532804
2-(2,6-dimethylphenoxy)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
CID 4958548
2-(4-methylphenoxy)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
CID 4939471
(2R)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 96532803
N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide
CID 4939416
4-methyl-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]benzamide
CID 566959
2-[2-(4-methylpiperidine-1-carbonyl)anilino]ethene-1,1,2-tricarbonitrile
CID 168607156
3-(2-chlorophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
CID 17179018

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide?
The IUPAC name of N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide (CID 4939344) is N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide is CC1CCN(C(=O)c2ccccc2NC(=O)C(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide?
The InChIKey is YVZQQAUOUXBIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28N2O2/c1-20-16-18-29(19-17-20)27(31)23-14-8-9-15-24(23)28-26(30)25(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,20,25H,16-19H2,1H3,(H,28,30).
What are the key properties of N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide?
N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide has a molecular weight of 412.53 g/mol, XLogP of 5.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide is sourced from PubChem (CID 4939344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).