N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine

C16H20N2O — CID 110432874

IUPACN-cyclopentyl-7-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2c(NC3CCCC3)cc(C)nc2c1
InChIInChI=1S/C16H20N2O/c1-11-9-15(18-12-5-3-4-6-12)14-8-7-13(19-2)10-16(14)17-11/h7-10,12H,3-6H2,1-2H3,(H,17,18)
InChIKeyLBHHSCBNIBHIAZ-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.91
Rot. Bonds3

About N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine

N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine (PubChem CID 110432874) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine.

Molecular Properties

Compound NameN-cyclopentyl-7-methoxy-2-methylquinolin-4-amine
PubChem CID110432874
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-cyclopentyl-7-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2c(NC3CCCC3)cc(C)nc2c1
InChIInChI=1S/C16H20N2O/c1-11-9-15(18-12-5-3-4-6-12)14-8-7-13(19-2)10-16(14)17-11/h7-10,12H,3-6H2,1-2H3,(H,17,18)
InChIKeyLBHHSCBNIBHIAZ-UHFFFAOYSA-N
XLogP3.91
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine?
The IUPAC name of N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine (CID 110432874) is N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine.
What is the SMILES notation for N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine?
The canonical SMILES for N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine is COc1ccc2c(NC3CCCC3)cc(C)nc2c1.
What is the InChIKey of N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine?
The InChIKey is LBHHSCBNIBHIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11-9-15(18-12-5-3-4-6-12)14-8-7-13(19-2)10-16(14)17-11/h7-10,12H,3-6H2,1-2H3,(H,17,18).
What are the key properties of N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine?
N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine is sourced from PubChem (CID 110432874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).