3-[(naphthalen-2-ylamino)methyl]phenol

C17H15NO — CID 43680286

IUPAC3-[(naphthalen-2-ylamino)methyl]phenol
SMILESOc1cccc(CNc2ccc3ccccc3c2)c1
InChIInChI=1S/C17H15NO/c19-17-7-3-4-13(10-17)12-18-16-9-8-14-5-1-2-6-15(14)11-16/h1-11,18-19H,12H2
InChIKeySBFRGZSYDWGSFT-UHFFFAOYSA-N
MW249.31 g/mol
LogP4.16
Rot. Bonds3

About 3-[(naphthalen-2-ylamino)methyl]phenol

3-[(naphthalen-2-ylamino)methyl]phenol (PubChem CID 43680286) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is 3-[(naphthalen-2-ylamino)methyl]phenol.

Molecular Properties

Compound Name3-[(naphthalen-2-ylamino)methyl]phenol
PubChem CID43680286
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name3-[(naphthalen-2-ylamino)methyl]phenol
SMILESOc1cccc(CNc2ccc3ccccc3c2)c1
InChIInChI=1S/C17H15NO/c19-17-7-3-4-13(10-17)12-18-16-9-8-14-5-1-2-6-15(14)11-16/h1-11,18-19H,12H2
InChIKeySBFRGZSYDWGSFT-UHFFFAOYSA-N
XLogP4.16
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(naphthalen-2-ylamino)methyl]phenol
CID 13418576
3-[(3-hydroxyanilino)methyl]phenol
CID 21321439
N-[[3-(aminomethyl)phenyl]methyl]naphthalen-2-amine
CID 115212943
3-[(naphthalen-2-ylamino)methyl]benzamide
CID 43533069
5-[(3-hydroxyphenyl)methylamino]-2-methylphenol
CID 22983329
N-[(4-chlorophenyl)methyl]naphthalen-2-amine
CID 13418586
3-(methoxymethyl)-N-(naphthalen-2-ylmethyl)aniline
CID 43672062
3-[[4-(difluoromethoxy)anilino]methyl]phenol
CID 28623903
N-[[6-[(naphthalen-2-ylamino)methyl]-2-pyridinyl]methyl]naphthalen-2-amine
CID 21130226
3-[[3-(difluoromethoxy)anilino]methyl]phenol
CID 43698912
3-[[(2-methyl-1,3-benzothiazol-6-yl)amino]methyl]phenol
CID 43682648
3-bromo-N-(naphthalen-2-ylmethyl)aniline
CID 28555096

Frequently Asked Questions

What is the IUPAC name of 3-[(naphthalen-2-ylamino)methyl]phenol?
The IUPAC name of 3-[(naphthalen-2-ylamino)methyl]phenol (CID 43680286) is 3-[(naphthalen-2-ylamino)methyl]phenol.
What is the SMILES notation for 3-[(naphthalen-2-ylamino)methyl]phenol?
The canonical SMILES for 3-[(naphthalen-2-ylamino)methyl]phenol is Oc1cccc(CNc2ccc3ccccc3c2)c1.
What is the InChIKey of 3-[(naphthalen-2-ylamino)methyl]phenol?
The InChIKey is SBFRGZSYDWGSFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c19-17-7-3-4-13(10-17)12-18-16-9-8-14-5-1-2-6-15(14)11-16/h1-11,18-19H,12H2.
What are the key properties of 3-[(naphthalen-2-ylamino)methyl]phenol?
3-[(naphthalen-2-ylamino)methyl]phenol has a molecular weight of 249.31 g/mol, XLogP of 4.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(naphthalen-2-ylamino)methyl]phenol is sourced from PubChem (CID 43680286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).