CID 101454794

C11H14N — CID 101454794

IUPAC—
SMILESC=C(CCC[NH])c1ccccc1
InChIInChI=1S/C11H14N/c1-10(6-5-9-12)11-7-3-2-4-8-11/h2-4,7-8,12H,1,5-6,9H2
InChIKeyCHBJADBXLBULLI-UHFFFAOYSA-N
MW160.24 g/mol
LogP2.76
Rot. Bonds4

About CID 101454794

CID 101454794 (PubChem CID 101454794) has the molecular formula C11H14N and a molecular weight of 160.24 g/mol.

Molecular Properties

Compound NameCID 101454794
PubChem CID101454794
Molecular FormulaC11H14N
Molecular Weight160.24 g/mol
Exact Mass160.11
IUPAC Name—
SMILESC=C(CCC[NH])c1ccccc1
InChIInChI=1S/C11H14N/c1-10(6-5-9-12)11-7-3-2-4-8-11/h2-4,7-8,12H,1,5-6,9H2
InChIKeyCHBJADBXLBULLI-UHFFFAOYSA-N
XLogP2.76
TPSA23.80 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.24
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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5-chlorohept-1-en-2-ylbenzene
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Frequently Asked Questions

What is the IUPAC name of CID 101454794?
The IUPAC name of CID 101454794 (CID 101454794) is not available.
What is the SMILES notation for CID 101454794?
The canonical SMILES for CID 101454794 is C=C(CCC[NH])c1ccccc1.
What is the InChIKey of CID 101454794?
The InChIKey is CHBJADBXLBULLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N/c1-10(6-5-9-12)11-7-3-2-4-8-11/h2-4,7-8,12H,1,5-6,9H2.
What are the key properties of CID 101454794?
CID 101454794 has a molecular weight of 160.24 g/mol, XLogP of 2.76, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 101454794 is sourced from PubChem (CID 101454794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).