nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane

C12H8 — CID 101267008

IUPACnonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane
SMILESC12C3C4C1C15C6C7C8C6C41C38C275
InChIInChI=1S/C12H8/c1-2-4-3(1)11-7-5-6-8(7)12(4,11)10(2,6)9(1,5)11/h1-8H
InChIKeyFMEVHFQFQYQBSL-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.98
Rot. Bonds

About nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane

nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane (PubChem CID 101267008) has the molecular formula C12H8 and a molecular weight of 152.20 g/mol. Its IUPAC name is nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane.

Molecular Properties

Compound Namenonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane
PubChem CID101267008
Molecular FormulaC12H8
Molecular Weight152.20 g/mol
Exact Mass152.06
IUPAC Namenonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane
SMILESC12C3C4C1C15C6C7C8C6C41C38C275
InChIInChI=1S/C12H8/c1-2-4-3(1)11-7-5-6-8(7)12(4,11)10(2,6)9(1,5)11/h1-8H
InChIKeyFMEVHFQFQYQBSL-UHFFFAOYSA-N
XLogP0.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(22S,23S,24S,25S,26S,27S,28S,29S,30R,32R,33R,34R,35R,36R,37R)-tetratriacontacyclo[35.1.1.14,36.15,35.16,34.17,33.18,32.19,31.110,30.111,29.112,28.113,27.114,26.115,25.116,24.117,23.118,20.03,39.022,54.039,40.040,41.041,42.042,43.043,44.044,45.045,46.046,47.047,48.048,49.049,50.050,51.051,52.052,53.053,54]tetrapentacontane
CID 59330514
cyclobutane;icosacyclo[21.1.1.14,22.15,21.16,20.17,19.18,18.19,17.110,16.111,13.03,25.015,33.025,26.026,27.027,28.028,29.029,30.030,31.031,32.032,33]tritriacontane
CID 158465043
nonacyclo[5.5.0.01,11.02,4.02,6.03,12.04,10.05,9.08,11]dodecane
CID 58958838
CID 59762681
CID 59762681
1-N,1-N,4-N,4-N-tetrafluorocubane-1,4-diamine
CID 102216195
(8S)-8-methylhexadecacyclo[13.11.1.01,14.02,5.02,13.03,26.04,7.05,12.06,9.06,11.016,19.017,24.017,27.018,21.018,23.025,27]heptacosane
CID 174300171
pentadecacyclo[12.11.0.01,16.02,5.02,13.03,25.04,7.05,12.06,9.06,11.015,18.016,24.017,19.017,23.019,22]pentacosane
CID 174075049
4,5,6,9,10,11-hexamethylhexacyclo[6.4.0.01,10.02,5.02,7.03,12]dodecane
CID 174043765
heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane
CID 59762676
1,4-difluorocubane
CID 11819150
(1R,2R,3S,6S,7S,8S)-4-iodo-5-[(1R,2S,3S,6R,7S,8S)-5-iodo-4-pentacyclo[4.3.0.02,4.03,8.05,7]nonanyl]pentacyclo[4.3.0.02,4.03,8.05,7]nonane
CID 22833797
(13S,15S,16R,18S,45R,46S)-hexatriacontacyclo[26.2.2.25,26.26,25.27,24.28,9.210,11.216,19.220,21.222,23.113,15.127,32.03,31.030,32.14,33.112,44.018,45.031,50.033,34.034,36.035,37.035,50.036,38.037,39.038,40.039,52.040,52.041,42.041,51.042,48.043,44.043,47.045,46.046,49.047,49.048,51]dopentacontane
CID 149398796

Frequently Asked Questions

What is the IUPAC name of nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane?
The IUPAC name of nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane (CID 101267008) is nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane.
What is the SMILES notation for nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane?
The canonical SMILES for nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane is C12C3C4C1C15C6C7C8C6C41C38C275.
What is the InChIKey of nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane?
The InChIKey is FMEVHFQFQYQBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8/c1-2-4-3(1)11-7-5-6-8(7)12(4,11)10(2,6)9(1,5)11/h1-8H.
What are the key properties of nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane?
nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane has a molecular weight of 152.20 g/mol, XLogP of 0.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for nonacyclo[6.4.0.01,6.02,5.02,11.03,8.03,10.04,7.09,12]dodecane is sourced from PubChem (CID 101267008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).