15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene

C21H14 — CID 140872789

IUPAC15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene
SMILESCc1ccc2c3c(cccc13)-c1c-2ccc2ccccc12
InChIInChI=1S/C21H14/c1-13-9-11-17-18-12-10-14-5-2-3-6-16(14)21(18)19-8-4-7-15(13)20(17)19/h2-12H,1H3
InChIKeyUHYIMVYWJBDCCK-UHFFFAOYSA-N
MW266.34 g/mol
LogP5.95
Rot. Bonds

About 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene

15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene (PubChem CID 140872789) has the molecular formula C21H14 and a molecular weight of 266.34 g/mol. Its IUPAC name is 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene.

Molecular Properties

Compound Name15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene
PubChem CID140872789
Molecular FormulaC21H14
Molecular Weight266.34 g/mol
Exact Mass266.11
IUPAC Name15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene
SMILESCc1ccc2c3c(cccc13)-c1c-2ccc2ccccc12
InChIInChI=1S/C21H14/c1-13-9-11-17-18-12-10-14-5-2-3-6-16(14)21(18)19-8-4-7-15(13)20(17)19/h2-12H,1H3
InChIKeyUHYIMVYWJBDCCK-UHFFFAOYSA-N
XLogP5.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.34
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene with MolForge

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Related Compounds

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CID 15525083
2-methyl-1-(2-methylphenyl)naphthalene
CID 14204979
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CID 166133840
8-[1-(8-carboxynaphthalen-1-yl)naphthalen-2-yl]naphthalene-1-carboxylic acid
CID 175733393
2-methyl-1-(2-methylnaphthalen-1-yl)naphthalene;sulfane
CID 155977678
1-(2-methylphenyl)-2-phenylnaphthalene
CID 101418577
15-methyl-4,7-diazapentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene
CID 139667404
5-methylacenaphthylene-1,2-dione
CID 13004585
1-(4-fluoranthen-1-ylnaphthalen-1-yl)fluoranthene
CID 139892613
ethane;1-methylchrysene;6-methylchrysene;3-methylfluoranthene;1-methyltriphenylene;2-methyltriphenylene
CID 158817490

Frequently Asked Questions

What is the IUPAC name of 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene?
The IUPAC name of 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene (CID 140872789) is 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene.
What is the SMILES notation for 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene?
The canonical SMILES for 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene is Cc1ccc2c3c(cccc13)-c1c-2ccc2ccccc12.
What is the InChIKey of 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene?
The InChIKey is UHYIMVYWJBDCCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14/c1-13-9-11-17-18-12-10-14-5-2-3-6-16(14)21(18)19-8-4-7-15(13)20(17)19/h2-12H,1H3.
What are the key properties of 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene?
15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene has a molecular weight of 266.34 g/mol, XLogP of 5.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 15-methylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12(20),13,15,17-decaene is sourced from PubChem (CID 140872789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).