4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine

C12H20N4O2 — CID 112685180

IUPAC4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine
SMILESCOc1ccnc(NC(C)CN2CCOCC2)n1
InChIInChI=1S/C12H20N4O2/c1-10(9-16-5-7-18-8-6-16)14-12-13-4-3-11(15-12)17-2/h3-4,10H,5-9H2,1-2H3,(H,13,14,15)
InChIKeyJSHHJALBTBVLLY-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.62
Rot. Bonds5

About 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine

4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine (PubChem CID 112685180) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine
PubChem CID112685180
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine
SMILESCOc1ccnc(NC(C)CN2CCOCC2)n1
InChIInChI=1S/C12H20N4O2/c1-10(9-16-5-7-18-8-6-16)14-12-13-4-3-11(15-12)17-2/h3-4,10H,5-9H2,1-2H3,(H,13,14,15)
InChIKeyJSHHJALBTBVLLY-UHFFFAOYSA-N
XLogP0.62
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-methoxy-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 112683355
4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine
CID 62861950
N-(1-piperidin-1-ylpropan-2-yl)-4-propan-2-yloxypyrimidin-2-amine
CID 115974723
4-methoxy-N-(4-methoxybutan-2-yl)pyrimidin-2-amine
CID 112688333
4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-2-amine
CID 62959456
2-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-4-amine
CID 103721807
N-(2-morpholin-4-ylethyl)-4-propan-2-yloxypyrimidin-2-amine
CID 112636541
N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine
CID 94220826
1-(1-morpholin-4-ylpropan-2-ylamino)isoquinolin-7-ol
CID 106538109
6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 63586349
3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 75373063
3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 62733426

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine?
The IUPAC name of 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine (CID 112685180) is 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine?
The canonical SMILES for 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine is COc1ccnc(NC(C)CN2CCOCC2)n1.
What is the InChIKey of 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine?
The InChIKey is JSHHJALBTBVLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-10(9-16-5-7-18-8-6-16)14-12-13-4-3-11(15-12)17-2/h3-4,10H,5-9H2,1-2H3,(H,13,14,15).
What are the key properties of 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine?
4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine has a molecular weight of 252.32 g/mol, XLogP of 0.62, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine is sourced from PubChem (CID 112685180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).