2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide

C25H29N3O2 — CID 4824501

IUPAC2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide
SMILESCCOc1ccccc1N1CCN(C(C)C(=O)Nc2cccc3ccccc23)CC1
InChIInChI=1S/C25H29N3O2/c1-3-30-24-14-7-6-13-23(24)28-17-15-27(16-18-28)19(2)25(29)26-22-12-8-10-20-9-4-5-11-21(20)22/h4-14,19H,3,15-18H2,1-2H3,(H,26,29)
InChIKeyYEFGACXRAVQSSX-UHFFFAOYSA-N
MW403.53 g/mol
LogP4.39
Rot. Bonds6

About 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide

2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide (PubChem CID 4824501) has the molecular formula C25H29N3O2 and a molecular weight of 403.53 g/mol. Its IUPAC name is 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide.

Molecular Properties

Compound Name2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide
PubChem CID4824501
Molecular FormulaC25H29N3O2
Molecular Weight403.53 g/mol
Exact Mass403.23
IUPAC Name2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide
SMILESCCOc1ccccc1N1CCN(C(C)C(=O)Nc2cccc3ccccc23)CC1
InChIInChI=1S/C25H29N3O2/c1-3-30-24-14-7-6-13-23(24)28-17-15-27(16-18-28)19(2)25(29)26-22-12-8-10-20-9-4-5-11-21(20)22/h4-14,19H,3,15-18H2,1-2H3,(H,26,29)
InChIKeyYEFGACXRAVQSSX-UHFFFAOYSA-N
XLogP4.39
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.53
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]propanamide
CID 9430320
(2S)-N-(2,6-dichlorophenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]propanamide
CID 9430308
(2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide
CID 9430380
(2S)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-(3-fluorophenyl)propanamide
CID 9430316
(2S)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-(2,4,6-trichlorophenyl)propanamide
CID 2537382
N-(2-ethoxyphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 46631059
(2S)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide
CID 9430472
(2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]propanamide
CID 8691494
(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide
CID 9249291
N-naphthalen-1-yl-2-piperazin-1-ylpropanamide
CID 43089580
2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 78754849
(2R)-N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(2-ethoxyphenyl)piperazin-1-yl]propanamide
CID 9430394

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide?
The IUPAC name of 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide (CID 4824501) is 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide.
What is the SMILES notation for 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide?
The canonical SMILES for 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide is CCOc1ccccc1N1CCN(C(C)C(=O)Nc2cccc3ccccc23)CC1.
What is the InChIKey of 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide?
The InChIKey is YEFGACXRAVQSSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N3O2/c1-3-30-24-14-7-6-13-23(24)28-17-15-27(16-18-28)19(2)25(29)26-22-12-8-10-20-9-4-5-11-21(20)22/h4-14,19H,3,15-18H2,1-2H3,(H,26,29).
What are the key properties of 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide?
2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide has a molecular weight of 403.53 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide is sourced from PubChem (CID 4824501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).