2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine

C19H17NO — CID 114709441

IUPAC2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine
SMILESNC1CC(c2cccc3ccccc23)Oc2ccccc21
InChIInChI=1S/C19H17NO/c20-17-12-19(21-18-11-4-3-9-16(17)18)15-10-5-7-13-6-1-2-8-14(13)15/h1-11,17,19H,12,20H2
InChIKeyJPLADVGMDBGVCH-UHFFFAOYSA-N
MW275.35 g/mol
LogP4.36
Rot. Bonds1

About 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine

2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine (PubChem CID 114709441) has the molecular formula C19H17NO and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound Name2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine
PubChem CID114709441
Molecular FormulaC19H17NO
Molecular Weight275.35 g/mol
Exact Mass275.13
IUPAC Name2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine
SMILESNC1CC(c2cccc3ccccc23)Oc2ccccc21
InChIInChI=1S/C19H17NO/c20-17-12-19(21-18-11-4-3-9-16(17)18)15-10-5-7-13-6-1-2-8-14(13)15/h1-11,17,19H,12,20H2
InChIKeyJPLADVGMDBGVCH-UHFFFAOYSA-N
XLogP4.36
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine
CID 104945921
(4R)-2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine
CID 104946162
(4R)-2-isoquinolin-4-yl-3,4-dihydro-2H-chromen-4-amine
CID 104946165
(2S,4S)-2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-ol
CID 134948340
(4R)-2-(2,3-dimethoxyphenyl)-3,4-dihydro-2H-chromen-4-amine
CID 104946218
(4R)-2-(2-bromophenyl)-3,4-dihydro-2H-chromen-4-amine
CID 104946116
2-[2-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromen-4-amine
CID 114709531
(4S)-2-(4-ethylphenyl)-3,4-dihydro-2H-chromen-4-amine
CID 104945818
(4R)-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine
CID 104946079
(4R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,4-dihydro-2H-chromen-4-amine
CID 104946217
(2R,4R)-2-chloro-3,4-dihydro-2H-chromen-4-amine
CID 141093967
(4S)-2-(2-chloro-6-fluorophenyl)-3,4-dihydro-2H-chromen-4-amine
CID 104945891

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine (CID 114709441) is 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine is NC1CC(c2cccc3ccccc23)Oc2ccccc21.
What is the InChIKey of 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is JPLADVGMDBGVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO/c20-17-12-19(21-18-11-4-3-9-16(17)18)15-10-5-7-13-6-1-2-8-14(13)15/h1-11,17,19H,12,20H2.
What are the key properties of 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine?
2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 275.35 g/mol, XLogP of 4.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 114709441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).