1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine

C23H26N2O — CID 138106389

IUPAC1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine
SMILESCN1CCN(Cc2ccc3ccc(OCc4ccccc4)cc3c2)CC1
InChIInChI=1S/C23H26N2O/c1-24-11-13-25(14-12-24)17-20-7-8-21-9-10-23(16-22(21)15-20)26-18-19-5-3-2-4-6-19/h2-10,15-16H,11-14,17-18H2,1H3
InChIKeyDPINHEPKWKGQEC-UHFFFAOYSA-N
MW346.47 g/mol
LogP4.17
Rot. Bonds5

About 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine

1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine (PubChem CID 138106389) has the molecular formula C23H26N2O and a molecular weight of 346.47 g/mol. Its IUPAC name is 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine.

Molecular Properties

Compound Name1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine
PubChem CID138106389
Molecular FormulaC23H26N2O
Molecular Weight346.47 g/mol
Exact Mass346.20
IUPAC Name1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine
SMILESCN1CCN(Cc2ccc3ccc(OCc4ccccc4)cc3c2)CC1
InChIInChI=1S/C23H26N2O/c1-24-11-13-25(14-12-24)17-20-7-8-21-9-10-23(16-22(21)15-20)26-18-19-5-3-2-4-6-19/h2-10,15-16H,11-14,17-18H2,1H3
InChIKeyDPINHEPKWKGQEC-UHFFFAOYSA-N
XLogP4.17
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine 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

N-methyl-3-[(4-methylpiperazin-1-yl)methyl]-N-(4-phenylmethoxyphenyl)aniline
CID 118954533
1-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-4-methylpiperazine
CID 782865
1,4-bis[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane
CID 6480590
2-methyl-7-phenylmethoxynaphthalene
CID 90146760
7-phenylmethoxynaphthalene-2-carboxylic acid
CID 22243430
N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide
CID 19578268
1-methyl-4-[1-[(3-phenylmethoxyphenyl)methyl]pyrrolidin-3-yl]piperazine
CID 74248786
1-(naphthalen-2-ylmethyl)-4-(3-phenylpropyl)piperazine
CID 59382224
2-benzyl-5-phenylmethoxy-1,3-dihydroisoindole
CID 171397259
2-tert-butyl-7-phenylmethoxynaphthalene
CID 146249475
1-benzyl-4-methylpiperazine;methanamine
CID 174694163
1-methyl-4-[(3-propoxyphenyl)methyl]piperazine
CID 70470634

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine?
The IUPAC name of 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine (CID 138106389) is 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine.
What is the SMILES notation for 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine?
The canonical SMILES for 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine is CN1CCN(Cc2ccc3ccc(OCc4ccccc4)cc3c2)CC1.
What is the InChIKey of 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine?
The InChIKey is DPINHEPKWKGQEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O/c1-24-11-13-25(14-12-24)17-20-7-8-21-9-10-23(16-22(21)15-20)26-18-19-5-3-2-4-6-19/h2-10,15-16H,11-14,17-18H2,1H3.
What are the key properties of 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine?
1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine has a molecular weight of 346.47 g/mol, XLogP of 4.17, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine is sourced from PubChem (CID 138106389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).