6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine

C11H10ClN3O2 — CID 19095701

IUPAC6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine
SMILESCOc1ccccc1Oc1c(N)ncnc1Cl
InChIInChI=1S/C11H10ClN3O2/c1-16-7-4-2-3-5-8(7)17-9-10(12)14-6-15-11(9)13/h2-6H,1H3,(H2,13,14,15)
InChIKeyAAMLJUYFMWWQJI-UHFFFAOYSA-N
MW251.67 g/mol
LogP2.51
Rot. Bonds3

About 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine

6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine (PubChem CID 19095701) has the molecular formula C11H10ClN3O2 and a molecular weight of 251.67 g/mol. Its IUPAC name is 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine
PubChem CID19095701
Molecular FormulaC11H10ClN3O2
Molecular Weight251.67 g/mol
Exact Mass251.05
IUPAC Name6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine
SMILESCOc1ccccc1Oc1c(N)ncnc1Cl
InChIInChI=1S/C11H10ClN3O2/c1-16-7-4-2-3-5-8(7)17-9-10(12)14-6-15-11(9)13/h2-6H,1H3,(H2,13,14,15)
InChIKeyAAMLJUYFMWWQJI-UHFFFAOYSA-N
XLogP2.51
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.67
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4,6-dichloro-5-(2-methoxyphenoxy)pyrimidine;pyrimidine
CID 87134636
5-chloro-4-N-(2-methoxyphenyl)-4-N-methylpyrimidine-4,6-diamine
CID 114049829
2-(3-bromophenyl)-6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine
CID 156704968
6-(2,3-dimethoxyphenyl)-5-methoxypyrimidin-4-amine
CID 82794447
4,6-dichloro-5-methoxypyrimidine;ethane
CID 144589632
4-chloro-5-(2-methoxyphenoxy)-6-methyl-2-pyrimidin-2-ylpyrimidine
CID 59532567
4,6-dichloro-2-(4-chlorophenyl)-5-(2-methoxyphenoxy)pyrimidine
CID 156768151
6-(2-methoxyphenoxy)-4-N-methylpyrimidine-4,5-diamine
CID 19135149
4-chloro-6-(2-chlorophenoxy)pyrimidin-5-amine
CID 46172362
3-chloro-5-methoxy-6-(2-methoxyphenoxy)-4-methylpyridazine
CID 141062507
4-(3-chlorophenyl)-6-(2-methoxyphenoxy)pyrimidin-5-amine
CID 90488510
1,2,4,5-tetrafluoro-3,6-bis(2-methoxyphenoxy)benzene
CID 1380018

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine?
The IUPAC name of 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine (CID 19095701) is 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine.
What is the SMILES notation for 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine?
The canonical SMILES for 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine is COc1ccccc1Oc1c(N)ncnc1Cl.
What is the InChIKey of 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine?
The InChIKey is AAMLJUYFMWWQJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3O2/c1-16-7-4-2-3-5-8(7)17-9-10(12)14-6-15-11(9)13/h2-6H,1H3,(H2,13,14,15).
What are the key properties of 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine?
6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine has a molecular weight of 251.67 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(2-methoxyphenoxy)pyrimidin-4-amine is sourced from PubChem (CID 19095701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).