(2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide

C18H29N3O2 — CID 9430380

IUPAC(2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)[C@@H](C)N1CCN(c2ccccc2OCC)CC1
InChIInChI=1S/C18H29N3O2/c1-4-10-19-18(22)15(3)20-11-13-21(14-12-20)16-8-6-7-9-17(16)23-5-2/h6-9,15H,4-5,10-14H2,1-3H3,(H,19,22)/t15-/m1/s1
InChIKeyMWAUUZHIJLJCRC-OAHLLOKOSA-N
MW319.45 g/mol
LogP2.12
Rot. Bonds7

About (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide

(2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide (PubChem CID 9430380) has the molecular formula C18H29N3O2 and a molecular weight of 319.45 g/mol. Its IUPAC name is (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide.

Molecular Properties

Compound Name(2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide
PubChem CID9430380
Molecular FormulaC18H29N3O2
Molecular Weight319.45 g/mol
Exact Mass319.23
IUPAC Name(2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)[C@@H](C)N1CCN(c2ccccc2OCC)CC1
InChIInChI=1S/C18H29N3O2/c1-4-10-19-18(22)15(3)20-11-13-21(14-12-20)16-8-6-7-9-17(16)23-5-2/h6-9,15H,4-5,10-14H2,1-3H3,(H,19,22)/t15-/m1/s1
InChIKeyMWAUUZHIJLJCRC-OAHLLOKOSA-N
XLogP2.12
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 78754849
(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
(2S)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]propanamide
CID 9430320
(2R)-N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(2-ethoxyphenyl)piperazin-1-yl]propanamide
CID 9430394
(2S)-N-(2,6-dichlorophenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]propanamide
CID 9430308
2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide
CID 4824501
(2S)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-(2,4,6-trichlorophenyl)propanamide
CID 2537382
(2S)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-(3-fluorophenyl)propanamide
CID 9430316
(2R)-N-[2-(dimethylamino)ethyl]-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 92984615
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide
CID 17392933
1-butyl-3-[1-[4-(2-ethoxyphenyl)piperazin-1-yl]-1-oxopropan-2-yl]urea
CID 42696645

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide?
The IUPAC name of (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide (CID 9430380) is (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide.
What is the SMILES notation for (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide?
The canonical SMILES for (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide is CCCNC(=O)[C@@H](C)N1CCN(c2ccccc2OCC)CC1.
What is the InChIKey of (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide?
The InChIKey is MWAUUZHIJLJCRC-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H29N3O2/c1-4-10-19-18(22)15(3)20-11-13-21(14-12-20)16-8-6-7-9-17(16)23-5-2/h6-9,15H,4-5,10-14H2,1-3H3,(H,19,22)/t15-/m1/s1.
What are the key properties of (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide?
(2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide has a molecular weight of 319.45 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-propylpropanamide is sourced from PubChem (CID 9430380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).