CID 58681482

C11H17N — CID 58681482

IUPAC—
SMILES[CH]C1=C(C)C2CCCN2CCC1
InChIInChI=1S/C11H17N/c1-9-5-3-7-12-8-4-6-11(12)10(9)2/h1,11H,3-8H2,2H3
InChIKeyUXRROEDUSJBBOT-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.27
Rot. Bonds

About CID 58681482

CID 58681482 (PubChem CID 58681482) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol.

Molecular Properties

Compound NameCID 58681482
PubChem CID58681482
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name—
SMILES[CH]C1=C(C)C2CCCN2CCC1
InChIInChI=1S/C11H17N/c1-9-5-3-7-12-8-4-6-11(12)10(9)2/h1,11H,3-8H2,2H3
InChIKeyUXRROEDUSJBBOT-UHFFFAOYSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 58681482?
The IUPAC name of CID 58681482 (CID 58681482) is not available.
What is the SMILES notation for CID 58681482?
The canonical SMILES for CID 58681482 is [CH]C1=C(C)C2CCCN2CCC1.
What is the InChIKey of CID 58681482?
The InChIKey is UXRROEDUSJBBOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-9-5-3-7-12-8-4-6-11(12)10(9)2/h1,11H,3-8H2,2H3.
What are the key properties of CID 58681482?
CID 58681482 has a molecular weight of 163.26 g/mol, XLogP of 2.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58681482 is sourced from PubChem (CID 58681482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).