2-naphthalen-1-yl-4H-chromene

C19H14O — CID 102038001

IUPAC2-naphthalen-1-yl-4H-chromene
SMILESC1=C(c2cccc3ccccc23)Oc2ccccc2C1
InChIInChI=1S/C19H14O/c1-3-9-16-14(6-1)8-5-10-17(16)19-13-12-15-7-2-4-11-18(15)20-19/h1-11,13H,12H2
InChIKeyOJFVCZJAPIDISW-UHFFFAOYSA-N
MW258.32 g/mol
LogP4.82
Rot. Bonds1

About 2-naphthalen-1-yl-4H-chromene

2-naphthalen-1-yl-4H-chromene (PubChem CID 102038001) has the molecular formula C19H14O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-naphthalen-1-yl-4H-chromene.

Molecular Properties

Compound Name2-naphthalen-1-yl-4H-chromene
PubChem CID102038001
Molecular FormulaC19H14O
Molecular Weight258.32 g/mol
Exact Mass258.10
IUPAC Name2-naphthalen-1-yl-4H-chromene
SMILESC1=C(c2cccc3ccccc23)Oc2ccccc2C1
InChIInChI=1S/C19H14O/c1-3-9-16-14(6-1)8-5-10-17(16)19-13-12-15-7-2-4-11-18(15)20-19/h1-11,13H,12H2
InChIKeyOJFVCZJAPIDISW-UHFFFAOYSA-N
XLogP4.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-naphthalen-1-yl-9H-xanthene
CID 90993396
2-(4-bromophenyl)-4H-chromene
CID 135086325
2-chloro-4H-chromene
CID 66790877
CID 175282704
CID 175282704
bis(1-naphthalen-1-ylnaphthalene);phosphane
CID 175426418
tetrakis(1-naphthalen-1-ylnaphthalene);tetrahydrochloride
CID 173126408
1-naphthalen-1-ylnaphthalene;tetrahydrochloride
CID 68981096
1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
CID 59169251
4-(4H-chromen-2-yl)-1,2-thiazole
CID 91234249
1-naphthalen-1-ylnaphthalene;ruthenium(2+);dichloride
CID 11327769
9,10-dihydrophenanthrene;phenanthrene
CID 159340402
biphenylene;9H-xanthene
CID 69049558

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-4H-chromene?
The IUPAC name of 2-naphthalen-1-yl-4H-chromene (CID 102038001) is 2-naphthalen-1-yl-4H-chromene.
What is the SMILES notation for 2-naphthalen-1-yl-4H-chromene?
The canonical SMILES for 2-naphthalen-1-yl-4H-chromene is C1=C(c2cccc3ccccc23)Oc2ccccc2C1.
What is the InChIKey of 2-naphthalen-1-yl-4H-chromene?
The InChIKey is OJFVCZJAPIDISW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14O/c1-3-9-16-14(6-1)8-5-10-17(16)19-13-12-15-7-2-4-11-18(15)20-19/h1-11,13H,12H2.
What are the key properties of 2-naphthalen-1-yl-4H-chromene?
2-naphthalen-1-yl-4H-chromene has a molecular weight of 258.32 g/mol, XLogP of 4.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-4H-chromene is sourced from PubChem (CID 102038001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).