2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide

C24H32N2O3 — CID 132660321

IUPAC2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide
SMILESCCc1ccccc1OC(C)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1
InChIInChI=1S/C24H32N2O3/c1-4-20-7-5-6-8-23(20)28-18(2)24(27)25-17-19-9-11-21(12-10-19)29-22-13-15-26(3)16-14-22/h5-12,18,22H,4,13-17H2,1-3H3,(H,25,27)
InChIKeyCMEUVLLFWDCGPB-UHFFFAOYSA-N
MW396.53 g/mol
LogP3.81
Rot. Bonds8

About 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide

2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide (PubChem CID 132660321) has the molecular formula C24H32N2O3 and a molecular weight of 396.53 g/mol. Its IUPAC name is 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide.

Molecular Properties

Compound Name2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide
PubChem CID132660321
Molecular FormulaC24H32N2O3
Molecular Weight396.53 g/mol
Exact Mass396.24
IUPAC Name2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide
SMILESCCc1ccccc1OC(C)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1
InChIInChI=1S/C24H32N2O3/c1-4-20-7-5-6-8-23(20)28-18(2)24(27)25-17-19-9-11-21(12-10-19)29-22-13-15-26(3)16-14-22/h5-12,18,22H,4,13-17H2,1-3H3,(H,25,27)
InChIKeyCMEUVLLFWDCGPB-UHFFFAOYSA-N
XLogP3.81
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.53
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(2-ethylphenoxy)-N-[4-(1-methylpiperidin-4-yl)oxyphenyl]propanamide
CID 99972529
(2S)-2-(2,3-dimethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]butanamide
CID 99972645
(2R)-2-(4-methoxyphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]butanamide
CID 99971607
2-(2-methoxyphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]acetamide
CID 99970858
(2S)-2-(2-methoxyphenoxy)-N-[4-(1-methylpiperidin-4-yl)oxyphenyl]propanamide
CID 99972736
1-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]-3-phenylurea
CID 50875367
2-(2-methoxyphenoxy)-N-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]propanamide
CID 132657777
N-[(3,4-diethoxyphenyl)methyl]-2-(2-ethylphenoxy)propanamide
CID 43907670
(2S)-N-[(4-ethoxyphenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 94018489
N-[(3-ethoxyphenyl)methyl]-2-(2-ethylphenoxy)propanamide
CID 46770916
2-(2-ethylphenoxy)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]propanamide
CID 46763837
2-(4-fluorophenoxy)-N-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]propanamide
CID 56919529

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide?
The IUPAC name of 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide (CID 132660321) is 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide.
What is the SMILES notation for 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide?
The canonical SMILES for 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide is CCc1ccccc1OC(C)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1.
What is the InChIKey of 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide?
The InChIKey is CMEUVLLFWDCGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O3/c1-4-20-7-5-6-8-23(20)28-18(2)24(27)25-17-19-9-11-21(12-10-19)29-22-13-15-26(3)16-14-22/h5-12,18,22H,4,13-17H2,1-3H3,(H,25,27).
What are the key properties of 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide?
2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide has a molecular weight of 396.53 g/mol, XLogP of 3.81, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]propanamide is sourced from PubChem (CID 132660321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).