8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine

C14H12N4O — CID 62960007

IUPAC8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine
SMILESCc1ccnc(Oc2ccc(N)c3cccnc23)n1
InChIInChI=1S/C14H12N4O/c1-9-6-8-17-14(18-9)19-12-5-4-11(15)10-3-2-7-16-13(10)12/h2-8H,15H2,1H3
InChIKeyPFVLEAGJAQDJAX-UHFFFAOYSA-N
MW252.28 g/mol
LogP2.71
Rot. Bonds2

About 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine

8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine (PubChem CID 62960007) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine.

Molecular Properties

Compound Name8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine
PubChem CID62960007
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC Name8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine
SMILESCc1ccnc(Oc2ccc(N)c3cccnc23)n1
InChIInChI=1S/C14H12N4O/c1-9-6-8-17-14(18-9)19-12-5-4-11(15)10-3-2-7-16-13(10)12/h2-8H,15H2,1H3
InChIKeyPFVLEAGJAQDJAX-UHFFFAOYSA-N
XLogP2.71
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(4-methylpyrimidin-2-yl)oxynaphthalen-1-amine
CID 55225577
8-[(5-methyl-2-pyridinyl)oxy]quinolin-5-amine
CID 60864239
8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine
CID 65209502
8-(2-fluoro-5-methylphenoxy)quinolin-5-amine
CID 64855173
8-(4-chlorophenoxy)quinolin-5-amine
CID 43450277
4-chloro-2-(4-methylpyrimidin-2-yl)oxyaniline
CID 62960541
8-(3,5-dichlorophenoxy)quinolin-5-amine
CID 43621813
8-(2,3-dichlorophenoxy)quinolin-5-amine
CID 43450313
8-[(3-tert-butyl-1,2,4-thiadiazol-5-yl)oxy]quinolin-5-amine
CID 65274127
6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile
CID 64587987
5-[(2-methyl-4-pyridinyl)oxy]quinolin-8-amine
CID 116525610
8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine
CID 79840623

Frequently Asked Questions

What is the IUPAC name of 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine?
The IUPAC name of 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine (CID 62960007) is 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine.
What is the SMILES notation for 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine?
The canonical SMILES for 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine is Cc1ccnc(Oc2ccc(N)c3cccnc23)n1.
What is the InChIKey of 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine?
The InChIKey is PFVLEAGJAQDJAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c1-9-6-8-17-14(18-9)19-12-5-4-11(15)10-3-2-7-16-13(10)12/h2-8H,15H2,1H3.
What are the key properties of 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine?
8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine has a molecular weight of 252.28 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine is sourced from PubChem (CID 62960007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).