4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine

C14H19N5O — CID 143609875

IUPAC4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine
SMILESCOc1ccc(C)cc1-c1cc(NCCN)nc(N)n1
InChIInChI=1S/C14H19N5O/c1-9-3-4-12(20-2)10(7-9)11-8-13(17-6-5-15)19-14(16)18-11/h3-4,7-8H,5-6,15H2,1-2H3,(H3,16,17,18,19)
InChIKeyAGTYFNGZVSCYDQ-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.41
Rot. Bonds5

About 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine

4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine (PubChem CID 143609875) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine
PubChem CID143609875
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine
SMILESCOc1ccc(C)cc1-c1cc(NCCN)nc(N)n1
InChIInChI=1S/C14H19N5O/c1-9-3-4-12(20-2)10(7-9)11-8-13(17-6-5-15)19-14(16)18-11/h3-4,7-8H,5-6,15H2,1-2H3,(H3,16,17,18,19)
InChIKeyAGTYFNGZVSCYDQ-UHFFFAOYSA-N
XLogP1.41
TPSA99.08 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-2-amine
CID 62482749
4-methoxy-6-(2-methoxy-5-methylphenyl)pyrimidin-2-amine
CID 114052966
6-(5-chloro-2-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine
CID 90189267
6-N-ethyl-4-N-(2-methoxy-5-methylphenyl)pyrimidine-2,4,6-triamine
CID 80763447
4-(2-methoxy-5-methylphenyl)-2,6-dimethylpyrimidine
CID 116896903
4-N-(2-aminoethyl)-6-(2-methyl-5-phenylphenyl)pyrimidine-2,4-diamine;ethylbenzene
CID 142190147
6-(4-chloro-2-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine
CID 174775792
6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769427
4,6-bis(2,5-dimethoxyphenyl)pyrimidin-2-amine
CID 75359779
2-[4-[[2-amino-6-(5-chloro-2-methoxyphenyl)pyrimidin-4-yl]amino]phenyl]ethanol
CID 11406086
[6-(2-methoxy-5-methylphenyl)pyridazin-3-yl]hydrazine
CID 62044559
4-N-(3-aminopropyl)-6-(3,5-dimethylphenyl)pyrimidine-2,4-diamine
CID 174775661

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine?
The IUPAC name of 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine (CID 143609875) is 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine?
The canonical SMILES for 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine is COc1ccc(C)cc1-c1cc(NCCN)nc(N)n1.
What is the InChIKey of 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine?
The InChIKey is AGTYFNGZVSCYDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-9-3-4-12(20-2)10(7-9)11-8-13(17-6-5-15)19-14(16)18-11/h3-4,7-8H,5-6,15H2,1-2H3,(H3,16,17,18,19).
What are the key properties of 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine?
4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine has a molecular weight of 273.34 g/mol, XLogP of 1.41, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 143609875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).