4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide

C14H16N4O2 — CID 106793665

IUPAC4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide
SMILESCOc1cc(C)ccc1-c1nc(C)c(C(N)=O)c(N)n1
InChIInChI=1S/C14H16N4O2/c1-7-4-5-9(10(6-7)20-3)14-17-8(2)11(13(16)19)12(15)18-14/h4-6H,1-3H3,(H2,16,19)(H2,15,17,18)
InChIKeyPEKWZXSFVWGHAI-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.45
Rot. Bonds3

About 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide

4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide (PubChem CID 106793665) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide.

Molecular Properties

Compound Name4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide
PubChem CID106793665
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC Name4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide
SMILESCOc1cc(C)ccc1-c1nc(C)c(C(N)=O)c(N)n1
InChIInChI=1S/C14H16N4O2/c1-7-4-5-9(10(6-7)20-3)14-17-8(2)11(13(16)19)12(15)18-14/h4-6H,1-3H3,(H2,16,19)(H2,15,17,18)
InChIKeyPEKWZXSFVWGHAI-UHFFFAOYSA-N
XLogP1.45
TPSA104.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-amino-2-(4-chloro-2-methoxyphenyl)-6-methylpyrimidine-5-carboxylate
CID 106820046
2-[2-(2-methoxy-4-methylphenyl)-4,6-dimethylpyrimidin-5-yl]acetic acid
CID 106792870
4-amino-6-methyl-2-(2-methylphenyl)pyrimidine-5-carboxamide
CID 116648136
4-amino-2-(5-bromo-2-methylphenyl)-6-methylpyrimidine-5-carboxamide
CID 112751747
ethyl 4-amino-2-(2-methoxy-4-methylphenyl)pyrimidine-5-carboxylate
CID 106793658
4-(2-methoxy-4-methylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 106793544
1-[2-(2-methoxy-4-methylphenyl)-4-methylpyrimidin-5-yl]ethanone
CID 106793219
3-[2-(2-methoxy-4-methylphenyl)-4,6-dimethylpyrimidin-5-yl]propan-1-amine
CID 106793273
5-bromo-2-(2-methoxy-4-methylphenyl)pyrimidin-4-amine
CID 106793083
2-(2-methoxy-4-methylphenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 106792982
(1R)-1-[2-(2-methoxy-4-methylphenyl)-4-methylpyrimidin-5-yl]ethanamine
CID 106793249
[2-(2-methoxy-4-methylphenyl)-6-methylpyrimidin-4-yl]hydrazine
CID 106793108

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide?
The IUPAC name of 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide (CID 106793665) is 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide.
What is the SMILES notation for 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide?
The canonical SMILES for 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide is COc1cc(C)ccc1-c1nc(C)c(C(N)=O)c(N)n1.
What is the InChIKey of 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide?
The InChIKey is PEKWZXSFVWGHAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-7-4-5-9(10(6-7)20-3)14-17-8(2)11(13(16)19)12(15)18-14/h4-6H,1-3H3,(H2,16,19)(H2,15,17,18).
What are the key properties of 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide?
4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(2-methoxy-4-methylphenyl)-6-methylpyrimidine-5-carboxamide is sourced from PubChem (CID 106793665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).