(6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone

C18H21N3O2 — CID 37333871

IUPAC(6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone
SMILESCOc1ccc(C(=O)N2CCN(C)C[C@H]2c2ccccc2)cn1
InChIInChI=1S/C18H21N3O2/c1-20-10-11-21(16(13-20)14-6-4-3-5-7-14)18(22)15-8-9-17(23-2)19-12-15/h3-9,12,16H,10-11,13H2,1-2H3/t16-/m0/s1
InChIKeyDZXHBUZKYCKYMF-INIZCTEOSA-N
MW311.39 g/mol
LogP2.22
Rot. Bonds3

About (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone

(6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone (PubChem CID 37333871) has the molecular formula C18H21N3O2 and a molecular weight of 311.39 g/mol. Its IUPAC name is (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone.

Molecular Properties

Compound Name(6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone
PubChem CID37333871
Molecular FormulaC18H21N3O2
Molecular Weight311.39 g/mol
Exact Mass311.16
IUPAC Name(6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone
SMILESCOc1ccc(C(=O)N2CCN(C)C[C@H]2c2ccccc2)cn1
InChIInChI=1S/C18H21N3O2/c1-20-10-11-21(16(13-20)14-6-4-3-5-7-14)18(22)15-8-9-17(23-2)19-12-15/h3-9,12,16H,10-11,13H2,1-2H3/t16-/m0/s1
InChIKeyDZXHBUZKYCKYMF-INIZCTEOSA-N
XLogP2.22
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(2R)-2,4-dimethylpiperazin-1-yl]-(6-methoxy-3-pyridinyl)methanone
CID 97094124
(4-methoxyphenyl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 37332417
(4-methyl-2-phenylpiperazin-1-yl)-phenylmethanone
CID 4069484
(3-methoxy-4-methylphenyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 25489891
(2-anilinopyrimidin-5-yl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 97156878
(4-fluorophenyl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 37332392
(3-chloro-4,5-dimethoxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
CID 46533935
(4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone
CID 51251944
[6-[(2S)-1-(6-methoxypyridine-3-carbonyl)pyrrolidin-2-yl]-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 92623621
(2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
CID 43824710
(3-chlorophenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
CID 42891355
2-(4-methyl-2-phenylpiperazine-1-carbonyl)fluoren-9-one
CID 134042687

Frequently Asked Questions

What is the IUPAC name of (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone?
The IUPAC name of (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone (CID 37333871) is (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone.
What is the SMILES notation for (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone?
The canonical SMILES for (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone is COc1ccc(C(=O)N2CCN(C)C[C@H]2c2ccccc2)cn1.
What is the InChIKey of (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone?
The InChIKey is DZXHBUZKYCKYMF-INIZCTEOSA-N. The full InChI is InChI=1S/C18H21N3O2/c1-20-10-11-21(16(13-20)14-6-4-3-5-7-14)18(22)15-8-9-17(23-2)19-12-15/h3-9,12,16H,10-11,13H2,1-2H3/t16-/m0/s1.
What are the key properties of (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone?
(6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone has a molecular weight of 311.39 g/mol, XLogP of 2.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxy-3-pyridinyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone is sourced from PubChem (CID 37333871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).