4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine

C14H17N3O2 — CID 112690994

IUPAC4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine
SMILESCOc1cccc(CNc2nc(C)cc(OC)n2)c1
InChIInChI=1S/C14H17N3O2/c1-10-7-13(19-3)17-14(16-10)15-9-11-5-4-6-12(8-11)18-2/h4-8H,9H2,1-3H3,(H,15,16,17)
InChIKeyXJUXWWIMIHWKFT-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.41
Rot. Bonds5

About 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine

4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine (PubChem CID 112690994) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine
PubChem CID112690994
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine
SMILESCOc1cccc(CNc2nc(C)cc(OC)n2)c1
InChIInChI=1S/C14H17N3O2/c1-10-7-13(19-3)17-14(16-10)15-9-11-5-4-6-12(8-11)18-2/h4-8H,9H2,1-3H3,(H,15,16,17)
InChIKeyXJUXWWIMIHWKFT-UHFFFAOYSA-N
XLogP2.41
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine
CID 115974506
N-[(2,4-dimethoxyphenyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine
CID 115633925
2-N-[(3-methoxyphenyl)methyl]-6-methyl-1,3,5-triazine-2,4-diamine
CID 166178490
N-ethyl-4-(3-methoxyphenoxy)-6-methylpyrimidin-2-amine
CID 80864633
[3-[[(4,6-dimethoxypyrimidin-2-yl)amino]methyl]phenyl]methanol
CID 115355459
N-[4-[[4-(aminomethyl)phenyl]methylamino]-6-[(3-methoxyphenyl)methylamino]-1,3,5-triazin-2-yl]hydroxylamine
CID 134108535
4-methoxy-6-methyl-N-[(2-methylphenyl)methyl]pyrimidin-2-amine
CID 112691004
6-chloro-2-N-[(3-methoxyphenyl)methyl]-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80798291
N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-6-methylpyrimidin-2-amine
CID 115626945
2-N-[(3-methoxyphenyl)methyl]-6-methylpyridine-2,3-diamine
CID 81131728
N-[(3-methoxyphenyl)methyl]-2,5-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 122174850
N-[(2-bromophenyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine
CID 112691839

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine?
The IUPAC name of 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine (CID 112690994) is 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine?
The canonical SMILES for 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine is COc1cccc(CNc2nc(C)cc(OC)n2)c1.
What is the InChIKey of 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine?
The InChIKey is XJUXWWIMIHWKFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-10-7-13(19-3)17-14(16-10)15-9-11-5-4-6-12(8-11)18-2/h4-8H,9H2,1-3H3,(H,15,16,17).
What are the key properties of 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine?
4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine has a molecular weight of 259.31 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine is sourced from PubChem (CID 112690994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).