4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol

C19H22N2O2 — CID 135774295

IUPAC4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol
SMILESCOc1ccc(O)c(/C=N/c2ccc(N3CCCCC3)cc2)c1
InChIInChI=1S/C19H22N2O2/c1-23-18-9-10-19(22)15(13-18)14-20-16-5-7-17(8-6-16)21-11-3-2-4-12-21/h5-10,13-14,22H,2-4,11-12H2,1H3/b20-14+
InChIKeyKRPXDWHKFPEFRT-XSFVSMFZSA-N
MW310.40 g/mol
LogP4.14
Rot. Bonds4

About 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol

4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol (PubChem CID 135774295) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol.

Molecular Properties

Compound Name4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol
PubChem CID135774295
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol
SMILESCOc1ccc(O)c(/C=N/c2ccc(N3CCCCC3)cc2)c1
InChIInChI=1S/C19H22N2O2/c1-23-18-9-10-19(22)15(13-18)14-20-16-5-7-17(8-6-16)21-11-3-2-4-12-21/h5-10,13-14,22H,2-4,11-12H2,1H3/b20-14+
InChIKeyKRPXDWHKFPEFRT-XSFVSMFZSA-N
XLogP4.14
TPSA45.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-[(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]phenol
CID 126239963
4-methoxy-2-[(4-phenoxyphenyl)iminomethyl]phenol
CID 135681255
4-[(2-hydroxy-5-methoxyphenyl)methylideneamino]benzonitrile
CID 1040051
[4-[(2-hydroxy-5-methoxyphenyl)methylideneamino]phenyl]-phenylmethanone
CID 177256442
1-(4-methoxyphenyl)piperidine
CID 10130315
1-(2-methoxy-4-piperidin-1-ylphenyl)-N-(4-methylphenyl)methanimine
CID 126234630
2-[(3-chloro-4-methoxyphenyl)iminomethyl]-4-methoxyphenol
CID 135595566
4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol
CID 135787695
1-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]-N-(4-piperidin-1-ylphenyl)methanimine
CID 23966319
1-[4-[(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]phenyl]ethanone
CID 126236474
2-[[4-(4-ethylpiperazin-1-yl)phenyl]iminomethyl]-4-iodophenol
CID 1153982
2-[[4-(4-phenylpiperazin-1-yl)phenyl]iminomethyl]phenol
CID 3056190

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol?
The IUPAC name of 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol (CID 135774295) is 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol.
What is the SMILES notation for 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol?
The canonical SMILES for 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol is COc1ccc(O)c(/C=N/c2ccc(N3CCCCC3)cc2)c1.
What is the InChIKey of 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol?
The InChIKey is KRPXDWHKFPEFRT-XSFVSMFZSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-23-18-9-10-19(22)15(13-18)14-20-16-5-7-17(8-6-16)21-11-3-2-4-12-21/h5-10,13-14,22H,2-4,11-12H2,1H3/b20-14+.
What are the key properties of 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol?
4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol has a molecular weight of 310.40 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol is sourced from PubChem (CID 135774295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).