2-ethyl-4-propan-2-ylquinoline

C14H17N — CID 144871804

IUPAC2-ethyl-4-propan-2-ylquinoline
SMILESCCc1cc(C(C)C)c2ccccc2n1
InChIInChI=1S/C14H17N/c1-4-11-9-13(10(2)3)12-7-5-6-8-14(12)15-11/h5-10H,4H2,1-3H3
InChIKeyAPJXCWZRPQOJCN-UHFFFAOYSA-N
MW199.30 g/mol
LogP3.92
Rot. Bonds2

About 2-ethyl-4-propan-2-ylquinoline

2-ethyl-4-propan-2-ylquinoline (PubChem CID 144871804) has the molecular formula C14H17N and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-ethyl-4-propan-2-ylquinoline.

Molecular Properties

Compound Name2-ethyl-4-propan-2-ylquinoline
PubChem CID144871804
Molecular FormulaC14H17N
Molecular Weight199.30 g/mol
Exact Mass199.14
IUPAC Name2-ethyl-4-propan-2-ylquinoline
SMILESCCc1cc(C(C)C)c2ccccc2n1
InChIInChI=1S/C14H17N/c1-4-11-9-13(10(2)3)12-7-5-6-8-14(12)15-11/h5-10H,4H2,1-3H3
InChIKeyAPJXCWZRPQOJCN-UHFFFAOYSA-N
XLogP3.92
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-propan-2-ylquinoline?
The IUPAC name of 2-ethyl-4-propan-2-ylquinoline (CID 144871804) is 2-ethyl-4-propan-2-ylquinoline.
What is the SMILES notation for 2-ethyl-4-propan-2-ylquinoline?
The canonical SMILES for 2-ethyl-4-propan-2-ylquinoline is CCc1cc(C(C)C)c2ccccc2n1.
What is the InChIKey of 2-ethyl-4-propan-2-ylquinoline?
The InChIKey is APJXCWZRPQOJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N/c1-4-11-9-13(10(2)3)12-7-5-6-8-14(12)15-11/h5-10H,4H2,1-3H3.
What are the key properties of 2-ethyl-4-propan-2-ylquinoline?
2-ethyl-4-propan-2-ylquinoline has a molecular weight of 199.30 g/mol, XLogP of 3.92, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-propan-2-ylquinoline is sourced from PubChem (CID 144871804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).