(4-pentan-2-yloxyquinolin-2-yl)methanamine

C15H20N2O — CID 102985707

IUPAC(4-pentan-2-yloxyquinolin-2-yl)methanamine
SMILESCCCC(C)Oc1cc(CN)nc2ccccc12
InChIInChI=1S/C15H20N2O/c1-3-6-11(2)18-15-9-12(10-16)17-14-8-5-4-7-13(14)15/h4-5,7-9,11H,3,6,10,16H2,1-2H3
InChIKeyPVLVWSSXXHNXCR-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.26
Rot. Bonds5

About (4-pentan-2-yloxyquinolin-2-yl)methanamine

(4-pentan-2-yloxyquinolin-2-yl)methanamine (PubChem CID 102985707) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is (4-pentan-2-yloxyquinolin-2-yl)methanamine.

Molecular Properties

Compound Name(4-pentan-2-yloxyquinolin-2-yl)methanamine
PubChem CID102985707
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name(4-pentan-2-yloxyquinolin-2-yl)methanamine
SMILESCCCC(C)Oc1cc(CN)nc2ccccc12
InChIInChI=1S/C15H20N2O/c1-3-6-11(2)18-15-9-12(10-16)17-14-8-5-4-7-13(14)15/h4-5,7-9,11H,3,6,10,16H2,1-2H3
InChIKeyPVLVWSSXXHNXCR-UHFFFAOYSA-N
XLogP3.26
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-pentan-2-yloxyquinolin-2-yl)methyl]propan-1-amine
CID 102985914
(4-heptoxyquinolin-2-yl)methanamine
CID 63377719
N-[(4-butan-2-yloxyquinolin-2-yl)methyl]-2-methylpropan-2-amine
CID 63377139
(4-phenylmethoxyquinolin-2-yl)methanamine
CID 63377220
2-chloro-4-pentan-2-yloxyquinazoline
CID 102981560
2-(chloromethyl)-4-(1-phenylethoxy)quinoline
CID 63445964
[4-(3,4-dimethylphenoxy)quinolin-2-yl]methanamine
CID 63377590
[4-(2,3-dimethylphenoxy)quinolin-2-yl]methanamine
CID 63377413
2-(aminomethyl)-N-propan-2-ylquinolin-4-amine
CID 84681230
(2-bromo-6-pentan-2-yloxyphenyl)methanamine
CID 102980133
[4-(3,4-dichlorophenoxy)quinolin-2-yl]methanamine
CID 63377726
2-(chloromethyl)-4-(3-methylbutoxy)quinoline
CID 55185069

Frequently Asked Questions

What is the IUPAC name of (4-pentan-2-yloxyquinolin-2-yl)methanamine?
The IUPAC name of (4-pentan-2-yloxyquinolin-2-yl)methanamine (CID 102985707) is (4-pentan-2-yloxyquinolin-2-yl)methanamine.
What is the SMILES notation for (4-pentan-2-yloxyquinolin-2-yl)methanamine?
The canonical SMILES for (4-pentan-2-yloxyquinolin-2-yl)methanamine is CCCC(C)Oc1cc(CN)nc2ccccc12.
What is the InChIKey of (4-pentan-2-yloxyquinolin-2-yl)methanamine?
The InChIKey is PVLVWSSXXHNXCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-3-6-11(2)18-15-9-12(10-16)17-14-8-5-4-7-13(14)15/h4-5,7-9,11H,3,6,10,16H2,1-2H3.
What are the key properties of (4-pentan-2-yloxyquinolin-2-yl)methanamine?
(4-pentan-2-yloxyquinolin-2-yl)methanamine has a molecular weight of 244.34 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-pentan-2-yloxyquinolin-2-yl)methanamine is sourced from PubChem (CID 102985707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).