2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide

C23H28N2O3 — CID 17179652

IUPAC2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
SMILESCc1ccccc1OC(C)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1
InChIInChI=1S/C23H28N2O3/c1-16-12-14-25(15-13-16)23(27)19-8-10-20(11-9-19)24-22(26)18(3)28-21-7-5-4-6-17(21)2/h4-11,16,18H,12-15H2,1-3H3,(H,24,26)
InChIKeyAYMFSBVHDPJKLK-UHFFFAOYSA-N
MW380.49 g/mol
LogP4.27
Rot. Bonds5

About 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide

2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide (PubChem CID 17179652) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide.

Molecular Properties

Compound Name2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
PubChem CID17179652
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Name2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
SMILESCc1ccccc1OC(C)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1
InChIInChI=1S/C23H28N2O3/c1-16-12-14-25(15-13-16)23(27)19-8-10-20(11-9-19)24-22(26)18(3)28-21-7-5-4-6-17(21)2/h4-11,16,18H,12-15H2,1-3H3,(H,24,26)
InChIKeyAYMFSBVHDPJKLK-UHFFFAOYSA-N
XLogP4.27
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylphenoxy)-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 17196352
(2R)-2-(2-methylphenoxy)-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]propanamide
CID 42505330
2-(4-methoxyphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
CID 17179657
2-(4-cyanophenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
CID 87037828
(2S)-2-amino-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide;hydrochloride
CID 119301656
2-(2-chlorophenoxy)-N-[3-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
CID 43886884
2-(2-methoxyphenoxy)-N-[4-(morpholine-4-carbonyl)phenyl]propanamide
CID 17194742
2-(2-methylphenoxy)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 133166702
(2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide
CID 837411
N-[4-[2-(2-methylphenoxy)propanoylamino]phenyl]benzamide
CID 17235390
2-(2-methylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
CID 17340229
2-(2,6-dimethylphenoxy)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
CID 4958548

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide?
The IUPAC name of 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide (CID 17179652) is 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide.
What is the SMILES notation for 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide?
The canonical SMILES for 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide is Cc1ccccc1OC(C)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1.
What is the InChIKey of 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide?
The InChIKey is AYMFSBVHDPJKLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-16-12-14-25(15-13-16)23(27)19-8-10-20(11-9-19)24-22(26)18(3)28-21-7-5-4-6-17(21)2/h4-11,16,18H,12-15H2,1-3H3,(H,24,26).
What are the key properties of 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide?
2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide has a molecular weight of 380.49 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide is sourced from PubChem (CID 17179652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).