(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide

C23H31N3O2 — CID 9249291

IUPAC(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide
SMILESCOc1ccccc1N1CCN([C@H](C)C(=O)Nc2ccccc2C(C)C)CC1
InChIInChI=1S/C23H31N3O2/c1-17(2)19-9-5-6-10-20(19)24-23(27)18(3)25-13-15-26(16-14-25)21-11-7-8-12-22(21)28-4/h5-12,17-18H,13-16H2,1-4H3,(H,24,27)/t18-/m1/s1
InChIKeyMABJRVOTZDDNLB-GOSISDBHSA-N
MW381.52 g/mol
LogP3.97
Rot. Bonds6

About (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide

(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide (PubChem CID 9249291) has the molecular formula C23H31N3O2 and a molecular weight of 381.52 g/mol. Its IUPAC name is (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide
PubChem CID9249291
Molecular FormulaC23H31N3O2
Molecular Weight381.52 g/mol
Exact Mass381.24
IUPAC Name(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide
SMILESCOc1ccccc1N1CCN([C@H](C)C(=O)Nc2ccccc2C(C)C)CC1
InChIInChI=1S/C23H31N3O2/c1-17(2)19-9-5-6-10-20(19)24-23(27)18(3)25-13-15-26(16-14-25)21-11-7-8-12-22(21)28-4/h5-12,17-18H,13-16H2,1-4H3,(H,24,27)/t18-/m1/s1
InChIKeyMABJRVOTZDDNLB-GOSISDBHSA-N
XLogP3.97
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.52
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(2-acetylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 9249385
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide
CID 17392933
N-tert-butyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 17445171
(2R)-N-(2-fluoro-4-methylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 32724400
(2S)-2-(4-phenylpiperazin-1-yl)-N-(2-propan-2-ylphenyl)propanamide
CID 9250174
methyl 2-[4-(2-methoxyphenyl)piperazin-1-yl]propanoate
CID 47016293
N-(4-bromo-2-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 46631128
2-[4-(2-nitrophenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide
CID 24506735
(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(4-phenoxyphenyl)propanamide
CID 41123999
(2S)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]propanamide
CID 9430320
N-(3-chlorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 46054199
(2R)-2-(azocan-1-yl)-N-(2-propan-2-ylphenyl)propanamide
CID 9460394

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide?
The IUPAC name of (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide (CID 9249291) is (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide.
What is the SMILES notation for (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide?
The canonical SMILES for (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide is COc1ccccc1N1CCN([C@H](C)C(=O)Nc2ccccc2C(C)C)CC1.
What is the InChIKey of (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide?
The InChIKey is MABJRVOTZDDNLB-GOSISDBHSA-N. The full InChI is InChI=1S/C23H31N3O2/c1-17(2)19-9-5-6-10-20(19)24-23(27)18(3)25-13-15-26(16-14-25)21-11-7-8-12-22(21)28-4/h5-12,17-18H,13-16H2,1-4H3,(H,24,27)/t18-/m1/s1.
What are the key properties of (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide?
(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide has a molecular weight of 381.52 g/mol, XLogP of 3.97, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 9249291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).