4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine

C15H20N4O — CID 107541722

IUPAC4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine
SMILESCOc1ccccc1CN(C)c1nc(C)cc(CN)n1
InChIInChI=1S/C15H20N4O/c1-11-8-13(9-16)18-15(17-11)19(2)10-12-6-4-5-7-14(12)20-3/h4-8H,9-10,16H2,1-3H3
InChIKeyCGJACRADZRLGIF-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.89
Rot. Bonds5

About 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine

4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine (PubChem CID 107541722) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine
PubChem CID107541722
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine
SMILESCOc1ccccc1CN(C)c1nc(C)cc(CN)n1
InChIInChI=1S/C15H20N4O/c1-11-8-13(9-16)18-15(17-11)19(2)10-12-6-4-5-7-14(12)20-3/h4-8H,9-10,16H2,1-3H3
InChIKeyCGJACRADZRLGIF-UHFFFAOYSA-N
XLogP1.89
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(aminomethyl)-N-[(2-bromophenyl)methyl]-N,6-dimethylpyrimidin-2-amine
CID 107541717
N-[[2-(aminomethyl)phenyl]methyl]-4-methoxy-N,6-dimethylpyrimidin-2-amine
CID 115973315
4-(aminomethyl)-N-[(4-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine
CID 107541718
[2-[(2-methoxyphenyl)methyl]-6-methylpyrimidin-4-yl]methanamine
CID 62743741
N-[(2-methoxyphenyl)methyl]-N,5-dimethylpyrimidin-2-amine
CID 171327101
2-[(2-methoxyphenyl)methyl-methylamino]pyrimidine-4-carbothioamide
CID 107546787
4-(aminomethyl)-5-chloro-N-[(2-methoxyphenyl)methyl]-N-methylpyridin-2-amine
CID 114925953
2-[benzyl(methyl)amino]-N-[(2-methoxyphenyl)methyl]-6-methylpyrimidine-4-carboxamide
CID 109328208
4-(aminomethyl)-3-fluoro-N-[(2-methoxyphenyl)methyl]-N-methylaniline
CID 115366747
[6-[(2-methoxyphenyl)methyl-methylamino]pyrazin-2-yl]methanol
CID 66466375
5-(2-aminoethyl)-N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyridin-2-amine
CID 80630731
[4-fluoro-2-[[(2-methoxyphenyl)methyl-methylamino]methyl]phenyl]methanamine
CID 64770076

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine?
The IUPAC name of 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine (CID 107541722) is 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine?
The canonical SMILES for 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine is COc1ccccc1CN(C)c1nc(C)cc(CN)n1.
What is the InChIKey of 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine?
The InChIKey is CGJACRADZRLGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-11-8-13(9-16)18-15(17-11)19(2)10-12-6-4-5-7-14(12)20-3/h4-8H,9-10,16H2,1-3H3.
What are the key properties of 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine?
4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine has a molecular weight of 272.35 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N,6-dimethylpyrimidin-2-amine is sourced from PubChem (CID 107541722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).