CID 58681489

C11H17N — CID 58681489

IUPAC—
SMILES[CH]C1=C(C)C2CCCCN2CC1
InChIInChI=1S/C11H17N/c1-9-6-8-12-7-4-3-5-11(12)10(9)2/h1,11H,3-8H2,2H3
InChIKeyJTBIVTKMODAMGR-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.27
Rot. Bonds

About CID 58681489

CID 58681489 (PubChem CID 58681489) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol.

Molecular Properties

Compound NameCID 58681489
PubChem CID58681489
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name—
SMILES[CH]C1=C(C)C2CCCCN2CC1
InChIInChI=1S/C11H17N/c1-9-6-8-12-7-4-3-5-11(12)10(9)2/h1,11H,3-8H2,2H3
InChIKeyJTBIVTKMODAMGR-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 58681489?
The IUPAC name of CID 58681489 (CID 58681489) is not available.
What is the SMILES notation for CID 58681489?
The canonical SMILES for CID 58681489 is [CH]C1=C(C)C2CCCCN2CC1.
What is the InChIKey of CID 58681489?
The InChIKey is JTBIVTKMODAMGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-9-6-8-12-7-4-3-5-11(12)10(9)2/h1,11H,3-8H2,2H3.
What are the key properties of CID 58681489?
CID 58681489 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 58681489 is sourced from PubChem (CID 58681489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).