10b,10c-dihydropyren-1-ylmethanol

C17H14O — CID 134968186

IUPAC10b,10c-dihydropyren-1-ylmethanol
SMILESOCC1=C2C=CC3=CC=CC4=CC=C(C=C1)C2C34
InChIInChI=1S/C17H14O/c18-10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)17(13)16(11)12/h1-9,16-18H,10H2
InChIKeyNWTFUCQWUFGPPM-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.01
Rot. Bonds1

About 10b,10c-dihydropyren-1-ylmethanol

10b,10c-dihydropyren-1-ylmethanol (PubChem CID 134968186) has the molecular formula C17H14O and a molecular weight of 234.30 g/mol. Its IUPAC name is 10b,10c-dihydropyren-1-ylmethanol.

Molecular Properties

Compound Name10b,10c-dihydropyren-1-ylmethanol
PubChem CID134968186
Molecular FormulaC17H14O
Molecular Weight234.30 g/mol
Exact Mass234.10
IUPAC Name10b,10c-dihydropyren-1-ylmethanol
SMILESOCC1=C2C=CC3=CC=CC4=CC=C(C=C1)C2C34
InChIInChI=1S/C17H14O/c18-10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)17(13)16(11)12/h1-9,16-18H,10H2
InChIKeyNWTFUCQWUFGPPM-UHFFFAOYSA-N
XLogP3.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 10b,10c-dihydropyren-1-ylmethanol?
The IUPAC name of 10b,10c-dihydropyren-1-ylmethanol (CID 134968186) is 10b,10c-dihydropyren-1-ylmethanol.
What is the SMILES notation for 10b,10c-dihydropyren-1-ylmethanol?
The canonical SMILES for 10b,10c-dihydropyren-1-ylmethanol is OCC1=C2C=CC3=CC=CC4=CC=C(C=C1)C2C34.
What is the InChIKey of 10b,10c-dihydropyren-1-ylmethanol?
The InChIKey is NWTFUCQWUFGPPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O/c18-10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)17(13)16(11)12/h1-9,16-18H,10H2.
What are the key properties of 10b,10c-dihydropyren-1-ylmethanol?
10b,10c-dihydropyren-1-ylmethanol has a molecular weight of 234.30 g/mol, XLogP of 3.01, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10b,10c-dihydropyren-1-ylmethanol is sourced from PubChem (CID 134968186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).