2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine

C22H22N2O2 — CID 126619037

IUPAC2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine
SMILESCOc1cc(OCc2ccccc2)ccc1-c1ccc2c(n1)CCNC2
InChIInChI=1S/C22H22N2O2/c1-25-22-13-18(26-15-16-5-3-2-4-6-16)8-9-19(22)21-10-7-17-14-23-12-11-20(17)24-21/h2-10,13,23H,11-12,14-15H2,1H3
InChIKeyDRKDSQLIWGJUTE-UHFFFAOYSA-N
MW346.43 g/mol
LogP3.98
Rot. Bonds5

About 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine

2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine (PubChem CID 126619037) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine.

Molecular Properties

Compound Name2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine
PubChem CID126619037
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC Name2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine
SMILESCOc1cc(OCc2ccccc2)ccc1-c1ccc2c(n1)CCNC2
InChIInChI=1S/C22H22N2O2/c1-25-22-13-18(26-15-16-5-3-2-4-6-16)8-9-19(22)21-10-7-17-14-23-12-11-20(17)24-21/h2-10,13,23H,11-12,14-15H2,1H3
InChIKeyDRKDSQLIWGJUTE-UHFFFAOYSA-N
XLogP3.98
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine
CID 126618872
3-[2-(2-methoxy-4-phenylmethoxyphenyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]propanoic acid
CID 126618725
2-(3-fluoro-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine
CID 126618832
CID 123516675
CID 123516675
5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
CID 158418618
4-methylidene-6-phenylmethoxy-2,3-dihydro-1H-isoquinoline
CID 145043071
2-[(4-methoxyphenoxy)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 28903977
3-[2-[4-phenylmethoxy-2-(trifluoromethyl)phenyl]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]propanoic acid
CID 126618757
2-[4-(4-methoxyphenyl)-5-methyl-1H-pyrazol-3-yl]-5-phenylmethoxyphenol
CID 2022938
1-ethyl-2-methoxy-4-phenylmethoxybenzene
CID 130330824
6-phenylmethoxy-2,3-dihydro-1H-indole
CID 18932839
1-[4-(2-bromo-6-phenylmethoxy-3,4-dihydronaphthalen-1-yl)-3-methoxyphenyl]piperazine
CID 177318989

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine?
The IUPAC name of 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine (CID 126619037) is 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine.
What is the SMILES notation for 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine?
The canonical SMILES for 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine is COc1cc(OCc2ccccc2)ccc1-c1ccc2c(n1)CCNC2.
What is the InChIKey of 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine?
The InChIKey is DRKDSQLIWGJUTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-25-22-13-18(26-15-16-5-3-2-4-6-16)8-9-19(22)21-10-7-17-14-23-12-11-20(17)24-21/h2-10,13,23H,11-12,14-15H2,1H3.
What are the key properties of 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine?
2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine has a molecular weight of 346.43 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridine is sourced from PubChem (CID 126619037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).