4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide

C22H26N2O2 — CID 109047837

IUPAC4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
SMILESCC1CCCN(C(=O)c2ccc(C(=O)NCCc3ccccc3)cc2)C1
InChIInChI=1S/C22H26N2O2/c1-17-6-5-15-24(16-17)22(26)20-11-9-19(10-12-20)21(25)23-14-13-18-7-3-2-4-8-18/h2-4,7-12,17H,5-6,13-16H2,1H3,(H,23,25)
InChIKeyUXRHHNMDUOSJLG-UHFFFAOYSA-N
MW350.46 g/mol
LogP3.53
Rot. Bonds5

About 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide

4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide (PubChem CID 109047837) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound Name4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
PubChem CID109047837
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
SMILESCC1CCCN(C(=O)c2ccc(C(=O)NCCc3ccccc3)cc2)C1
InChIInChI=1S/C22H26N2O2/c1-17-6-5-15-24(16-17)22(26)20-11-9-19(10-12-20)21(25)23-14-13-18-7-3-2-4-8-18/h2-4,7-12,17H,5-6,13-16H2,1H3,(H,23,25)
InChIKeyUXRHHNMDUOSJLG-UHFFFAOYSA-N
XLogP3.53
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-methylpiperidine-1-carbonyl)-N-(3-phenylpropyl)benzamide
CID 109055941
4-(3-methylpiperidin-1-yl)sulfonyl-N-(2-phenylethyl)benzamide
CID 109061005
N-[2-(4-fluorophenyl)ethyl]-3-(3-methylpiperidine-1-carbonyl)benzamide
CID 109055423
N-[(2-methylphenyl)methyl]-4-(3-methylpiperidine-1-carbonyl)benzamide
CID 109046805
4-(2-ethylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
CID 109047836
1-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109070794
4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide
CID 109047024
6-(3-methylpiperidine-1-carbonyl)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109099081
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
[4-(chloromethyl)phenyl]-(3-methylpiperidin-1-yl)methanone
CID 43156245
[4-(3-methylpiperidine-1-carbonyl)phenyl]-(4-phenylpiperazin-1-yl)methanone
CID 109048199
(3-methylpiperidin-1-yl)-[5-(2-phenylethylamino)pyrazin-2-yl]methanone
CID 109283932

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide?
The IUPAC name of 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide (CID 109047837) is 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide.
What is the SMILES notation for 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide?
The canonical SMILES for 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide is CC1CCCN(C(=O)c2ccc(C(=O)NCCc3ccccc3)cc2)C1.
What is the InChIKey of 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide?
The InChIKey is UXRHHNMDUOSJLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-17-6-5-15-24(16-17)22(26)20-11-9-19(10-12-20)21(25)23-14-13-18-7-3-2-4-8-18/h2-4,7-12,17H,5-6,13-16H2,1H3,(H,23,25).
What are the key properties of 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide?
4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide has a molecular weight of 350.46 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 109047837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).