(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide

C22H29N3O2 — CID 92984622

IUPAC(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide
SMILESCOc1ccccc1N1CCN([C@H](C)C(=O)NCc2cccc(C)c2)CC1
InChIInChI=1S/C22H29N3O2/c1-17-7-6-8-19(15-17)16-23-22(26)18(2)24-11-13-25(14-12-24)20-9-4-5-10-21(20)27-3/h4-10,15,18H,11-14,16H2,1-3H3,(H,23,26)/t18-/m1/s1
InChIKeyQKMXXXJISPIGCN-GOSISDBHSA-N
MW367.49 g/mol
LogP2.83
Rot. Bonds6

About (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide

(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide (PubChem CID 92984622) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide
PubChem CID92984622
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC Name(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide
SMILESCOc1ccccc1N1CCN([C@H](C)C(=O)NCc2cccc(C)c2)CC1
InChIInChI=1S/C22H29N3O2/c1-17-7-6-8-19(15-17)16-23-22(26)18(2)24-11-13-25(14-12-24)20-9-4-5-10-21(20)27-3/h4-10,15,18H,11-14,16H2,1-3H3,(H,23,26)/t18-/m1/s1
InChIKeyQKMXXXJISPIGCN-GOSISDBHSA-N
XLogP2.83
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(benzylcarbamoyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 9249441
(2R)-N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(2-ethoxyphenyl)piperazin-1-yl]propanamide
CID 9430394
(2S)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]-N-[(2-methoxyphenyl)methyl]propanamide
CID 9432729
(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
N-[(3-methylphenyl)methyl]-4-(2-propan-2-yloxyphenyl)piperazine-1-carboxamide
CID 113106968
(2S)-N-benzyl-2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]propanamide
CID 9266113
(2R)-N-benzyl-2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]propanamide
CID 9266116
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
2-[4-(2-hydroxyphenyl)piperazin-1-yl]-N-[(4-methylphenyl)methyl]propanamide
CID 17450172
methyl 2-[4-(2-methoxyphenyl)piperazin-1-yl]propanoate
CID 47016293

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide?
The IUPAC name of (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide (CID 92984622) is (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide.
What is the SMILES notation for (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide?
The canonical SMILES for (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide is COc1ccccc1N1CCN([C@H](C)C(=O)NCc2cccc(C)c2)CC1.
What is the InChIKey of (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide?
The InChIKey is QKMXXXJISPIGCN-GOSISDBHSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-17-7-6-8-19(15-17)16-23-22(26)18(2)24-11-13-25(14-12-24)20-9-4-5-10-21(20)27-3/h4-10,15,18H,11-14,16H2,1-3H3,(H,23,26)/t18-/m1/s1.
What are the key properties of (2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide?
(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide has a molecular weight of 367.49 g/mol, XLogP of 2.83, 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-[(3-methylphenyl)methyl]propanamide is sourced from PubChem (CID 92984622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).