1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine

C18H24N2 — CID 107416963

IUPAC1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine
SMILESCc1cc(CNCC2CCCC2C)c2ccccc2n1
InChIInChI=1S/C18H24N2/c1-13-6-5-7-15(13)11-19-12-16-10-14(2)20-18-9-4-3-8-17(16)18/h3-4,8-10,13,15,19H,5-7,11-12H2,1-2H3
InChIKeyOJIUCGJKIKAQLR-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.07
Rot. Bonds4

About 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine

1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine (PubChem CID 107416963) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine
PubChem CID107416963
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine
SMILESCc1cc(CNCC2CCCC2C)c2ccccc2n1
InChIInChI=1S/C18H24N2/c1-13-6-5-7-15(13)11-19-12-16-10-14(2)20-18-9-4-3-8-17(16)18/h3-4,8-10,13,15,19H,5-7,11-12H2,1-2H3
InChIKeyOJIUCGJKIKAQLR-UHFFFAOYSA-N
XLogP4.07
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine?
The IUPAC name of 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine (CID 107416963) is 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine.
What is the SMILES notation for 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine?
The canonical SMILES for 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine is Cc1cc(CNCC2CCCC2C)c2ccccc2n1.
What is the InChIKey of 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine?
The InChIKey is OJIUCGJKIKAQLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-13-6-5-7-15(13)11-19-12-16-10-14(2)20-18-9-4-3-8-17(16)18/h3-4,8-10,13,15,19H,5-7,11-12H2,1-2H3.
What are the key properties of 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine?
1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine has a molecular weight of 268.40 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopentyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine is sourced from PubChem (CID 107416963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).