4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol

C18H17NO2 — CID 14499224

IUPAC4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol
SMILESCOc1ccc2cc(N(C)c3ccc(O)cc3)ccc2c1
InChIInChI=1S/C18H17NO2/c1-19(15-6-8-17(20)9-7-15)16-5-3-14-12-18(21-2)10-4-13(14)11-16/h3-12,20H,1-2H3
InChIKeySROXYVAAGSHPJU-UHFFFAOYSA-N
MW279.34 g/mol
LogP4.32
Rot. Bonds3

About 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol

4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol (PubChem CID 14499224) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol.

Molecular Properties

Compound Name4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol
PubChem CID14499224
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol
SMILESCOc1ccc2cc(N(C)c3ccc(O)cc3)ccc2c1
InChIInChI=1S/C18H17NO2/c1-19(15-6-8-17(20)9-7-15)16-5-3-14-12-18(21-2)10-4-13(14)11-16/h3-12,20H,1-2H3
InChIKeySROXYVAAGSHPJU-UHFFFAOYSA-N
XLogP4.32
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-N,N-dimethylnaphthalen-2-amine
CID 117043645
4-methoxy-N-(4-methoxyphenyl)-N-methylaniline;hydrochloride
CID 175476332
N-(6-methoxynaphthalen-2-yl)-N-oxidohydroxylamine
CID 163172105
methane;4-methoxyphenol
CID 159494332
[(6-methoxynaphthalen-2-yl)-methylamino]methanethiol
CID 115227861
bis(4-methoxyphenol);zirconium(2+);dichloride
CID 172849740
3-N-(4-methoxyphenyl)-1-N,1-N,3-N-trimethylbenzene-1,3-diamine
CID 110455032
N-(4-methoxyphenyl)-N,3-dimethylaniline
CID 58090553
N-(4-methoxyphenyl)-N-methyl-1H-indol-5-amine
CID 110455031
bis[4-(4-methoxy-N-methylanilino)phenyl]methanol
CID 139653192
5-methoxy-2-[(4-methoxy-N-methylanilino)methyl]phenol
CID 82978581
2-tert-butyl-6-methoxynaphthalene;6-tert-butylnaphthalen-2-ol
CID 159191921

Frequently Asked Questions

What is the IUPAC name of 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol?
The IUPAC name of 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol (CID 14499224) is 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol.
What is the SMILES notation for 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol?
The canonical SMILES for 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol is COc1ccc2cc(N(C)c3ccc(O)cc3)ccc2c1.
What is the InChIKey of 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol?
The InChIKey is SROXYVAAGSHPJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-19(15-6-8-17(20)9-7-15)16-5-3-14-12-18(21-2)10-4-13(14)11-16/h3-12,20H,1-2H3.
What are the key properties of 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol?
4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol has a molecular weight of 279.34 g/mol, XLogP of 4.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-methoxynaphthalen-2-yl)-methylamino]phenol is sourced from PubChem (CID 14499224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).