N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine

C10H13N5O — CID 66327904

IUPACN-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine
SMILESCOc1ncnc(NCc2ncc[nH]2)c1C
InChIInChI=1S/C10H13N5O/c1-7-9(14-6-15-10(7)16-2)13-5-8-11-3-4-12-8/h3-4,6H,5H2,1-2H3,(H,11,12)(H,13,14,15)
InChIKeyJMVLDEUPBQZOSJ-UHFFFAOYSA-N
MW219.25 g/mol
LogP1.13
Rot. Bonds4

About N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine

N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine (PubChem CID 66327904) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine
PubChem CID66327904
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC NameN-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine
SMILESCOc1ncnc(NCc2ncc[nH]2)c1C
InChIInChI=1S/C10H13N5O/c1-7-9(14-6-15-10(7)16-2)13-5-8-11-3-4-12-8/h3-4,6H,5H2,1-2H3,(H,11,12)(H,13,14,15)
InChIKeyJMVLDEUPBQZOSJ-UHFFFAOYSA-N
XLogP1.13
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-5-methyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
CID 66327251
6-methoxy-5-methyl-N-(1H-pyrazol-5-ylmethyl)pyrimidin-4-amine
CID 66327266
6-methoxy-5-methyl-N-propylpyrimidin-4-amine
CID 66326211
N-(6-methoxy-5-methylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 66327244
6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine
CID 114127983
6-methoxy-5-methyl-N-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-amine
CID 66325637
4-[[(6-methoxy-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 114148469
5-bromo-N-(1H-imidazol-2-ylmethyl)-4-methoxypyrimidin-2-amine
CID 106997790
N-(1H-imidazol-2-ylmethyl)-5-methoxypyrimidin-2-amine
CID 114600639
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-methoxy-5-methylpyrimidin-4-amine
CID 79241724
6-methoxy-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 66324994
N-hexyl-6-methoxy-5-methylpyrimidin-4-amine
CID 66325235

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine?
The IUPAC name of N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine (CID 66327904) is N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine?
The canonical SMILES for N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine is COc1ncnc(NCc2ncc[nH]2)c1C.
What is the InChIKey of N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine?
The InChIKey is JMVLDEUPBQZOSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-7-9(14-6-15-10(7)16-2)13-5-8-11-3-4-12-8/h3-4,6H,5H2,1-2H3,(H,11,12)(H,13,14,15).
What are the key properties of N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine?
N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine has a molecular weight of 219.25 g/mol, XLogP of 1.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine is sourced from PubChem (CID 66327904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).