6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine

C14H18N4O2 — CID 102903424

IUPAC6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine
SMILESCOCCc1ccccc1Nc1ncnc(OC)c1N
InChIInChI=1S/C14H18N4O2/c1-19-8-7-10-5-3-4-6-11(10)18-13-12(15)14(20-2)17-9-16-13/h3-6,9H,7-8,15H2,1-2H3,(H,16,17,18)
InChIKeyIWHVRFCPGUTUCW-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.00
Rot. Bonds6

About 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine

6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine (PubChem CID 102903424) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine.

Molecular Properties

Compound Name6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine
PubChem CID102903424
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine
SMILESCOCCc1ccccc1Nc1ncnc(OC)c1N
InChIInChI=1S/C14H18N4O2/c1-19-8-7-10-5-3-4-6-11(10)18-13-12(15)14(20-2)17-9-16-13/h3-6,9H,7-8,15H2,1-2H3,(H,16,17,18)
InChIKeyIWHVRFCPGUTUCW-UHFFFAOYSA-N
XLogP2.00
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-N-[2-(2-methoxyethyl)phenyl]pyridine-2,3-diamine
CID 102903407
4-N-[2-(2-methoxyethyl)phenyl]-5-propan-2-ylpyrimidine-4,6-diamine
CID 102908789
4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,6-diamine
CID 102908724
6-chloro-N-[2-(2-methoxyethyl)phenyl]-5-propylpyrimidin-4-amine
CID 102907328
6-chloro-4-N-[2-(methoxymethyl)phenyl]pyrimidine-4,5-diamine
CID 63023250
6-N-(2-methoxyethyl)-4-N-(2-methoxyphenyl)pyrimidine-4,5,6-triamine
CID 19148143
6-chloro-4-N-(2-propylphenyl)pyrimidine-4,5-diamine
CID 55143311
4-N-(2-ethylphenyl)pyrimidine-4,5,6-triamine
CID 22544045
3,5-dibromo-N-[2-(2-methoxyethyl)phenyl]pyridin-2-amine
CID 102907825
4-N-(2-ethylphenyl)-6-N-phenylpyrimidine-4,5,6-triamine
CID 22544115
6-(3,4-dimethylphenoxy)-4-N-(2-ethylphenyl)pyrimidine-4,5-diamine
CID 22544216
4-N-[2-(2-methoxyethyl)phenyl]pyridine-3,4-diamine
CID 102903431

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine?
The IUPAC name of 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine (CID 102903424) is 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine.
What is the SMILES notation for 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine?
The canonical SMILES for 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine is COCCc1ccccc1Nc1ncnc(OC)c1N.
What is the InChIKey of 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine?
The InChIKey is IWHVRFCPGUTUCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-19-8-7-10-5-3-4-6-11(10)18-13-12(15)14(20-2)17-9-16-13/h3-6,9H,7-8,15H2,1-2H3,(H,16,17,18).
What are the key properties of 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine?
6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine has a molecular weight of 274.32 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-N-[2-(2-methoxyethyl)phenyl]pyrimidine-4,5-diamine is sourced from PubChem (CID 102903424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).