CID 58907693

C12H18 — CID 58907693

IUPAC—
SMILES[CH]C12CCCCC1([CH])CCCC2
InChIInChI=1S/C12H18/c1-11-7-3-5-9-12(11,2)10-6-4-8-11/h1-2H,3-10H2
InChIKeyKXUHYIZUELUUFV-UHFFFAOYSA-N
MW162.28 g/mol
LogP3.53
Rot. Bonds

About CID 58907693

CID 58907693 (PubChem CID 58907693) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol.

Molecular Properties

Compound NameCID 58907693
PubChem CID58907693
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Name—
SMILES[CH]C12CCCCC1([CH])CCCC2
InChIInChI=1S/C12H18/c1-11-7-3-5-9-12(11,2)10-6-4-8-11/h1-2H,3-10H2
InChIKeyKXUHYIZUELUUFV-UHFFFAOYSA-N
XLogP3.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

spiro[4.4]nonane
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(1-aminocyclohexyl)-dimethylsulfanium
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spiro[4.4]nonane;dihydrochloride
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dispiro[2.2.46.23]dodecane
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spiro[2.4]heptane
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1-(aminomethyl)-N,N-dihydroxycyclooctan-1-amine
CID 23318253
1-methanidyl-1-methylcyclohexane;2-methylpropane;oxoosmium
CID 163793076
1-tert-butyl-1-methylcyclopentane
CID 21351462
spiro[2.4]heptane;spiro[3.4]octane
CID 145351897
spiro[2.7]decane
CID 12657449
1,3,5-trimethylcyclononane-1,3,5-triamine
CID 163899329
1,2,2-tribromocyclohexan-1-amine
CID 54015976

Frequently Asked Questions

What is the IUPAC name of CID 58907693?
The IUPAC name of CID 58907693 (CID 58907693) is not available.
What is the SMILES notation for CID 58907693?
The canonical SMILES for CID 58907693 is [CH]C12CCCCC1([CH])CCCC2.
What is the InChIKey of CID 58907693?
The InChIKey is KXUHYIZUELUUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18/c1-11-7-3-5-9-12(11,2)10-6-4-8-11/h1-2H,3-10H2.
What are the key properties of CID 58907693?
CID 58907693 has a molecular weight of 162.28 g/mol, XLogP of 3.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58907693 is sourced from PubChem (CID 58907693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).