5-cyclopropyl-N,2-dimethylaniline

C11H15N — CID 145267775

IUPAC5-cyclopropyl-N,2-dimethylaniline
SMILESCNc1cc(C2CC2)ccc1C
InChIInChI=1S/C11H15N/c1-8-3-4-10(9-5-6-9)7-11(8)12-2/h3-4,7,9,12H,5-6H2,1-2H3
InChIKeyKNLXBSOKILKMIP-UHFFFAOYSA-N
MW161.25 g/mol
LogP2.91
Rot. Bonds2

About 5-cyclopropyl-N,2-dimethylaniline

5-cyclopropyl-N,2-dimethylaniline (PubChem CID 145267775) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is 5-cyclopropyl-N,2-dimethylaniline.

Molecular Properties

Compound Name5-cyclopropyl-N,2-dimethylaniline
PubChem CID145267775
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name5-cyclopropyl-N,2-dimethylaniline
SMILESCNc1cc(C2CC2)ccc1C
InChIInChI=1S/C11H15N/c1-8-3-4-10(9-5-6-9)7-11(8)12-2/h3-4,7,9,12H,5-6H2,1-2H3
InChIKeyKNLXBSOKILKMIP-UHFFFAOYSA-N
XLogP2.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N,2-dimethylaniline?
The IUPAC name of 5-cyclopropyl-N,2-dimethylaniline (CID 145267775) is 5-cyclopropyl-N,2-dimethylaniline.
What is the SMILES notation for 5-cyclopropyl-N,2-dimethylaniline?
The canonical SMILES for 5-cyclopropyl-N,2-dimethylaniline is CNc1cc(C2CC2)ccc1C.
What is the InChIKey of 5-cyclopropyl-N,2-dimethylaniline?
The InChIKey is KNLXBSOKILKMIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-8-3-4-10(9-5-6-9)7-11(8)12-2/h3-4,7,9,12H,5-6H2,1-2H3.
What are the key properties of 5-cyclopropyl-N,2-dimethylaniline?
5-cyclopropyl-N,2-dimethylaniline has a molecular weight of 161.25 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N,2-dimethylaniline is sourced from PubChem (CID 145267775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).