6-propan-2-yl-N,3-dipropylquinolin-2-amine

C18H26N2 — CID 63525770

IUPAC6-propan-2-yl-N,3-dipropylquinolin-2-amine
SMILESCCCNc1nc2ccc(C(C)C)cc2cc1CCC
InChIInChI=1S/C18H26N2/c1-5-7-15-12-16-11-14(13(3)4)8-9-17(16)20-18(15)19-10-6-2/h8-9,11-13H,5-7,10H2,1-4H3,(H,19,20)
InChIKeySZRIMUHIBSPIMR-UHFFFAOYSA-N
MW270.42 g/mol
LogP5.13
Rot. Bonds6

About 6-propan-2-yl-N,3-dipropylquinolin-2-amine

6-propan-2-yl-N,3-dipropylquinolin-2-amine (PubChem CID 63525770) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 6-propan-2-yl-N,3-dipropylquinolin-2-amine.

Molecular Properties

Compound Name6-propan-2-yl-N,3-dipropylquinolin-2-amine
PubChem CID63525770
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name6-propan-2-yl-N,3-dipropylquinolin-2-amine
SMILESCCCNc1nc2ccc(C(C)C)cc2cc1CCC
InChIInChI=1S/C18H26N2/c1-5-7-15-12-16-11-14(13(3)4)8-9-17(16)20-18(15)19-10-6-2/h8-9,11-13H,5-7,10H2,1-4H3,(H,19,20)
InChIKeySZRIMUHIBSPIMR-UHFFFAOYSA-N
XLogP5.13
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.42
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-N,3-dipropylquinolin-2-amine?
The IUPAC name of 6-propan-2-yl-N,3-dipropylquinolin-2-amine (CID 63525770) is 6-propan-2-yl-N,3-dipropylquinolin-2-amine.
What is the SMILES notation for 6-propan-2-yl-N,3-dipropylquinolin-2-amine?
The canonical SMILES for 6-propan-2-yl-N,3-dipropylquinolin-2-amine is CCCNc1nc2ccc(C(C)C)cc2cc1CCC.
What is the InChIKey of 6-propan-2-yl-N,3-dipropylquinolin-2-amine?
The InChIKey is SZRIMUHIBSPIMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-5-7-15-12-16-11-14(13(3)4)8-9-17(16)20-18(15)19-10-6-2/h8-9,11-13H,5-7,10H2,1-4H3,(H,19,20).
What are the key properties of 6-propan-2-yl-N,3-dipropylquinolin-2-amine?
6-propan-2-yl-N,3-dipropylquinolin-2-amine has a molecular weight of 270.42 g/mol, XLogP of 5.13, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-N,3-dipropylquinolin-2-amine is sourced from PubChem (CID 63525770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).