CID 160611346

C10H20B — CID 160611346

IUPAC—
SMILESCC[C@@H]1CCCC[C@@H]1CC.[B]
InChIInChI=1S/C10H20.B/c1-3-9-7-5-6-8-10(9)4-2;/h9-10H,3-8H2,1-2H3;/t9-,10+;
InChIKeyVRMVFMQJCHXDQZ-JMVWIVNTSA-N
MW151.08 g/mol
LogP3.23
Rot. Bonds2

About CID 160611346

CID 160611346 (PubChem CID 160611346) has the molecular formula C10H20B and a molecular weight of 151.08 g/mol.

Molecular Properties

Compound NameCID 160611346
PubChem CID160611346
Molecular FormulaC10H20B
Molecular Weight151.08 g/mol
Exact Mass151.17
IUPAC Name—
SMILESCC[C@@H]1CCCC[C@@H]1CC.[B]
InChIInChI=1S/C10H20.B/c1-3-9-7-5-6-8-10(9)4-2;/h9-10H,3-8H2,1-2H3;/t9-,10+;
InChIKeyVRMVFMQJCHXDQZ-JMVWIVNTSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.08
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

carbonic acid;1,2-diethylcyclohexane
CID 70579518
[(1R,2R)-2-ethylcyclohexyl]methanol
CID 58154483
[(1S,2R)-2-ethylcyclohexyl]methanamine
CID 124508805
(1R)-1-ethyl-2-propylcyclohexane
CID 142312859
trans-(1R,2R)-1,2-diethylcyclobutane
CID 59110889
1,2,16-triethyl-15-methylcyclopentatriacontane
CID 123855410
ethane;(2S)-1-ethyl-2-propylcyclohexane
CID 143012565
cis-(1S,2S)-1-ethyl-2-methylcyclohexane
CID 23620237
7,8-diethyl-1,1-dimethylcyclotridecane
CID 123809995
ethane;trans-(1S,2R)-1-ethyl-2-methylcyclohexane
CID 143479638
1-(2-ethylcyclohexyl)propan-2-one
CID 79429645
1-butyl-2-ethylcyclopentane
CID 522474

Frequently Asked Questions

What is the IUPAC name of CID 160611346?
The IUPAC name of CID 160611346 (CID 160611346) is not available.
What is the SMILES notation for CID 160611346?
The canonical SMILES for CID 160611346 is CC[C@@H]1CCCC[C@@H]1CC.[B].
What is the InChIKey of CID 160611346?
The InChIKey is VRMVFMQJCHXDQZ-JMVWIVNTSA-N. The full InChI is InChI=1S/C10H20.B/c1-3-9-7-5-6-8-10(9)4-2;/h9-10H,3-8H2,1-2H3;/t9-,10+;.
What are the key properties of CID 160611346?
CID 160611346 has a molecular weight of 151.08 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 160611346 is sourced from PubChem (CID 160611346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).