4-methyltricyclo[4.2.1.03,9]nonane

C10H16 — CID 90722800

IUPAC4-methyltricyclo[4.2.1.03,9]nonane
SMILESCC1CC2CCC3CC1C23
InChIInChI=1S/C10H16/c1-6-4-7-2-3-8-5-9(6)10(7)8/h6-10H,2-5H2,1H3
InChIKeyYGHDIIRTHPWRSV-UHFFFAOYSA-N
MW136.24 g/mol
LogP2.69
Rot. Bonds

About 4-methyltricyclo[4.2.1.03,9]nonane

4-methyltricyclo[4.2.1.03,9]nonane (PubChem CID 90722800) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 4-methyltricyclo[4.2.1.03,9]nonane.

Molecular Properties

Compound Name4-methyltricyclo[4.2.1.03,9]nonane
PubChem CID90722800
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name4-methyltricyclo[4.2.1.03,9]nonane
SMILESCC1CC2CCC3CC1C23
InChIInChI=1S/C10H16/c1-6-4-7-2-3-8-5-9(6)10(7)8/h6-10H,2-5H2,1H3
InChIKeyYGHDIIRTHPWRSV-UHFFFAOYSA-N
XLogP2.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 521735
Tricyclo[6.2.0.02,6] decane
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Tricyclo[3.3.2.01,5]decane
CID 12729048
1,6-Dimethyltricyclo[5.3.0.02,6]decane
CID 177545722
1,2-Dimethyltricyclo[5.3.0.02,6]decane
CID 177545723
2,5-Ethanopentalene, octahydro-
CID 585857
(1S,2R,5R,7S)-2-methyltricyclo[5.3.0.02,5]decane
CID 10931616
Tricyclo[5.3.0.02,8]decane
CID 12770180
1,5-Dimethyl-8-propan-2-yltricyclo[5.3.0.02,6]decane
CID 12301986
Tetracyclo[6.3.0.02,6.03,11]undecane
CID 23524841
Tricyclo[5.3.0.0~3,10~]decane
CID 53439158
4,9-Diethyltricyclo[5.3.0.02,6]decane
CID 53817589

Frequently Asked Questions

What is the IUPAC name of 4-methyltricyclo[4.2.1.03,9]nonane?
The IUPAC name of 4-methyltricyclo[4.2.1.03,9]nonane (CID 90722800) is 4-methyltricyclo[4.2.1.03,9]nonane.
What is the SMILES notation for 4-methyltricyclo[4.2.1.03,9]nonane?
The canonical SMILES for 4-methyltricyclo[4.2.1.03,9]nonane is CC1CC2CCC3CC1C23.
What is the InChIKey of 4-methyltricyclo[4.2.1.03,9]nonane?
The InChIKey is YGHDIIRTHPWRSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-6-4-7-2-3-8-5-9(6)10(7)8/h6-10H,2-5H2,1H3.
What are the key properties of 4-methyltricyclo[4.2.1.03,9]nonane?
4-methyltricyclo[4.2.1.03,9]nonane has a molecular weight of 136.24 g/mol, XLogP of 2.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyltricyclo[4.2.1.03,9]nonane is sourced from PubChem (CID 90722800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).