(2-quinolin-3-yloxypyrimidin-5-yl)methanamine

C14H12N4O — CID 107387604

IUPAC(2-quinolin-3-yloxypyrimidin-5-yl)methanamine
SMILESNCc1cnc(Oc2cnc3ccccc3c2)nc1
InChIInChI=1S/C14H12N4O/c15-6-10-7-17-14(18-8-10)19-12-5-11-3-1-2-4-13(11)16-9-12/h1-5,7-9H,6,15H2
InChIKeyBLAXYSKFWNFECV-UHFFFAOYSA-N
MW252.28 g/mol
LogP2.28
Rot. Bonds3

About (2-quinolin-3-yloxypyrimidin-5-yl)methanamine

(2-quinolin-3-yloxypyrimidin-5-yl)methanamine (PubChem CID 107387604) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is (2-quinolin-3-yloxypyrimidin-5-yl)methanamine.

Molecular Properties

Compound Name(2-quinolin-3-yloxypyrimidin-5-yl)methanamine
PubChem CID107387604
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC Name(2-quinolin-3-yloxypyrimidin-5-yl)methanamine
SMILESNCc1cnc(Oc2cnc3ccccc3c2)nc1
InChIInChI=1S/C14H12N4O/c15-6-10-7-17-14(18-8-10)19-12-5-11-3-1-2-4-13(11)16-9-12/h1-5,7-9H,6,15H2
InChIKeyBLAXYSKFWNFECV-UHFFFAOYSA-N
XLogP2.28
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-quinolin-3-yloxyphenyl)ethanamine
CID 107388035
(2-quinolin-7-yloxypyrimidin-5-yl)methanamine
CID 107314265
2-quinolin-3-yloxyethanamine
CID 84661473
(2-chloro-4-quinolin-3-yloxyphenyl)methanamine
CID 107386840
3-[4-(bromomethyl)phenoxy]quinoline
CID 107387563
(4-bromo-2-quinolin-3-yloxyphenyl)methanamine
CID 107386867
3-(5-bromo-4-methoxypyrimidin-2-yl)oxyquinoline
CID 107387714
2-quinolin-3-yloxybutan-1-amine
CID 107386996
3-[[6-(chloromethyl)-2-pyridinyl]oxy]quinoline
CID 107387696
3-(bromomethoxy)quinoline
CID 54277099
3-prop-2-ynoxyquinoline
CID 102847055
2-quinolin-3-ylethanamine;hydrochloride
CID 68724239

Frequently Asked Questions

What is the IUPAC name of (2-quinolin-3-yloxypyrimidin-5-yl)methanamine?
The IUPAC name of (2-quinolin-3-yloxypyrimidin-5-yl)methanamine (CID 107387604) is (2-quinolin-3-yloxypyrimidin-5-yl)methanamine.
What is the SMILES notation for (2-quinolin-3-yloxypyrimidin-5-yl)methanamine?
The canonical SMILES for (2-quinolin-3-yloxypyrimidin-5-yl)methanamine is NCc1cnc(Oc2cnc3ccccc3c2)nc1.
What is the InChIKey of (2-quinolin-3-yloxypyrimidin-5-yl)methanamine?
The InChIKey is BLAXYSKFWNFECV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c15-6-10-7-17-14(18-8-10)19-12-5-11-3-1-2-4-13(11)16-9-12/h1-5,7-9H,6,15H2.
What are the key properties of (2-quinolin-3-yloxypyrimidin-5-yl)methanamine?
(2-quinolin-3-yloxypyrimidin-5-yl)methanamine has a molecular weight of 252.28 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-quinolin-3-yloxypyrimidin-5-yl)methanamine is sourced from PubChem (CID 107387604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).