2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide

C14H16N4O3 — CID 146290688

IUPAC2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide
SMILESCOc1cc(Oc2ccnc(NC(=O)CN)n2)ccc1C
InChIInChI=1S/C14H16N4O3/c1-9-3-4-10(7-11(9)20-2)21-13-5-6-16-14(18-13)17-12(19)8-15/h3-7H,8,15H2,1-2H3,(H,16,17,18,19)
InChIKeyUUMVKDRIJUBOSC-UHFFFAOYSA-N
MW288.31 g/mol
LogP1.48
Rot. Bonds5

About 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide

2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide (PubChem CID 146290688) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide.

Molecular Properties

Compound Name2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide
PubChem CID146290688
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC Name2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide
SMILESCOc1cc(Oc2ccnc(NC(=O)CN)n2)ccc1C
InChIInChI=1S/C14H16N4O3/c1-9-3-4-10(7-11(9)20-2)21-13-5-6-16-14(18-13)17-12(19)8-15/h3-7H,8,15H2,1-2H3,(H,16,17,18,19)
InChIKeyUUMVKDRIJUBOSC-UHFFFAOYSA-N
XLogP1.48
TPSA99.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

tert-butyl N-[1-[[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]amino]-2-methyl-1-oxopropan-2-yl]carbamate
CID 146289834
(2R)-2-amino-N-[4-(3-methoxy-4-methylphenoxy)-2-pyridinyl]butanamide
CID 146264472
6-[2-[3-[(2-aminoacetyl)amino]anilino]pyrimidin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide
CID 59224752
2-(3-methoxy-4-methylphenoxy)pyridine
CID 118928199
N-(4-methoxypyrimidin-2-yl)-3-methylbutanamide
CID 130219531
(2S)-2-amino-N-[6-(3-methoxy-4-methylphenoxy)-3-pyridinyl]-2-methylbutanamide
CID 67235584
2-amino-N-(4-naphthalen-2-yloxy-2-pyridinyl)acetamide
CID 146265187
4-methoxy-2-(2-methylpyrimidin-4-yl)oxybenzoic acid
CID 62770062
(2R)-2-amino-N-[6-(3-methoxy-4-methylphenoxy)-2-pyridinyl]butanamide;2,2,2-trifluoroacetic acid
CID 146264526
[(2R)-2-amino-1-[[6-(3-methoxy-4-methylphenoxy)-2-pyridinyl]amino]-1-oxobutan-2-yl] 2,2,2-trifluoroacetate
CID 162769495
2-amino-N-[2-(3-methoxy-4-methylphenyl)ethyl]acetamide
CID 119326320
2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide
CID 142030863

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide?
The IUPAC name of 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide (CID 146290688) is 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide.
What is the SMILES notation for 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide?
The canonical SMILES for 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide is COc1cc(Oc2ccnc(NC(=O)CN)n2)ccc1C.
What is the InChIKey of 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide?
The InChIKey is UUMVKDRIJUBOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c1-9-3-4-10(7-11(9)20-2)21-13-5-6-16-14(18-13)17-12(19)8-15/h3-7H,8,15H2,1-2H3,(H,16,17,18,19).
What are the key properties of 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide?
2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide has a molecular weight of 288.31 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(3-methoxy-4-methylphenoxy)pyrimidin-2-yl]acetamide is sourced from PubChem (CID 146290688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).