1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol

C15H26O — CID 14807649

IUPAC1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol
SMILESCC(C)C1CCC2(C)C3CCC(C)(O)C2C13
InChIInChI=1S/C15H26O/c1-9(2)10-5-7-14(3)11-6-8-15(4,16)13(14)12(10)11/h9-13,16H,5-8H2,1-4H3
InChIKeyAZCJPMYIWXNBMH-UHFFFAOYSA-N
MW222.37 g/mol
LogP3.47
Rot. Bonds1

About 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol

1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol (PubChem CID 14807649) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol.

Molecular Properties

Compound Name1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol
PubChem CID14807649
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol
SMILESCC(C)C1CCC2(C)C3CCC(C)(O)C2C13
InChIInChI=1S/C15H26O/c1-9(2)10-5-7-14(3)11-6-8-15(4,16)13(14)12(10)11/h9-13,16H,5-8H2,1-4H3
InChIKeyAZCJPMYIWXNBMH-UHFFFAOYSA-N
XLogP3.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 10955174
2-Pinanol
CID 10128
cis-2-Pinanol
CID 6428289
2-Pinanol, trans-
CID 1268143
3,5-Dimethyl-1-adamantanol
CID 265793
1,6-Methanonaphthalen-1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, (1alpha,4beta,4aalpha,6beta,8aalpha)-
CID 521903
2-Methyl-2-adamantanol
CID 136545
2-Propyladamantan-2-ol
CID 22042516
Pinanylhydroperoxide
CID 221170
(6S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol
CID 442384
Diamantan-1-ol
CID 141568
Diamantan-4-ol
CID 141578

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol?
The IUPAC name of 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol (CID 14807649) is 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol.
What is the SMILES notation for 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol?
The canonical SMILES for 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol is CC(C)C1CCC2(C)C3CCC(C)(O)C2C13.
What is the InChIKey of 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol?
The InChIKey is AZCJPMYIWXNBMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O/c1-9(2)10-5-7-14(3)11-6-8-15(4,16)13(14)12(10)11/h9-13,16H,5-8H2,1-4H3.
What are the key properties of 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol?
1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol has a molecular weight of 222.37 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]decan-3-ol is sourced from PubChem (CID 14807649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).