N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine

C12H17N5O — CID 66327883

IUPACN-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine
SMILESCOc1ncnc(NC(C)Cn2ccnc2)c1C
InChIInChI=1S/C12H17N5O/c1-9(6-17-5-4-13-8-17)16-11-10(2)12(18-3)15-7-14-11/h4-5,7-9H,6H2,1-3H3,(H,14,15,16)
InChIKeySLYOSOMBRFDOHH-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.49
Rot. Bonds5

About N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine

N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine (PubChem CID 66327883) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine
PubChem CID66327883
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC NameN-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine
SMILESCOc1ncnc(NC(C)Cn2ccnc2)c1C
InChIInChI=1S/C12H17N5O/c1-9(6-17-5-4-13-8-17)16-11-10(2)12(18-3)15-7-14-11/h4-5,7-9H,6H2,1-3H3,(H,14,15,16)
InChIKeySLYOSOMBRFDOHH-UHFFFAOYSA-N
XLogP1.49
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-bromo-N-(1-imidazol-1-ylpropan-2-yl)-4-methylpyridin-2-amine
CID 106875615
5-bromo-N-(1-imidazol-1-ylpropan-2-yl)-3-methylpyridin-2-amine
CID 79718384
4-N-(1-imidazol-1-ylpropan-2-yl)quinazoline-4,7-diamine
CID 65337116
4-N-(1-imidazol-1-ylpropan-2-yl)-6-N,5-dimethyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80985899
6-N-ethyl-4-N-(1-imidazol-1-ylpropan-2-yl)-5-nitropyrimidine-4,6-diamine
CID 80782851
4-[(6-methoxy-5-methylpyrimidin-4-yl)amino]pentanoic acid
CID 66334158
5-bromo-2-chloro-N-(1-imidazol-1-ylpropan-2-yl)pyrimidin-4-amine
CID 79076506
4-N-(1-imidazol-1-ylpropan-2-yl)-5-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80986213
6-methoxy-N-(1-methoxy-3-methylbutan-2-yl)-5-methylpyrimidin-4-amine
CID 66326464
2-N-(6-methoxy-5-methylpyrimidin-4-yl)-3-methylbutane-1,2-diamine
CID 66333366
6-chloro-N-(1-imidazol-1-ylpropan-2-yl)-5-methyl-2-propylpyrimidin-4-amine
CID 80972117
N-(1-imidazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731094

Frequently Asked Questions

What is the IUPAC name of N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine?
The IUPAC name of N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine (CID 66327883) is N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine?
The canonical SMILES for N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine is COc1ncnc(NC(C)Cn2ccnc2)c1C.
What is the InChIKey of N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine?
The InChIKey is SLYOSOMBRFDOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c1-9(6-17-5-4-13-8-17)16-11-10(2)12(18-3)15-7-14-11/h4-5,7-9H,6H2,1-3H3,(H,14,15,16).
What are the key properties of N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine?
N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine has a molecular weight of 247.30 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-imidazol-1-ylpropan-2-yl)-6-methoxy-5-methylpyrimidin-4-amine is sourced from PubChem (CID 66327883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).