2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine

C13H22N4O — CID 112868035

IUPAC2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine
SMILESCc1nc(NCC(C)C)cc(N2CCOCC2)n1
InChIInChI=1S/C13H22N4O/c1-10(2)9-14-12-8-13(16-11(3)15-12)17-4-6-18-7-5-17/h8,10H,4-7,9H2,1-3H3,(H,14,15,16)
InChIKeyFRGRRMMXDALJKG-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.69
Rot. Bonds4

About 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine

2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine (PubChem CID 112868035) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine
PubChem CID112868035
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine
SMILESCc1nc(NCC(C)C)cc(N2CCOCC2)n1
InChIInChI=1S/C13H22N4O/c1-10(2)9-14-12-8-13(16-11(3)15-12)17-4-6-18-7-5-17/h8,10H,4-7,9H2,1-3H3,(H,14,15,16)
InChIKeyFRGRRMMXDALJKG-UHFFFAOYSA-N
XLogP1.69
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)amino]ethyl]acetamide
CID 70702870
N-[2-(4-methoxyphenoxy)ethyl]-2-methyl-6-morpholin-4-ylpyrimidin-4-amine
CID 112869875
4-[6-(azepan-1-yl)-2-methylpyrimidin-4-yl]morpholine
CID 112869889
6-morpholin-4-yl-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80956097
4-methyl-N-[2-[(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)amino]ethyl]thiophene-2-carboxamide
CID 122294149
N-[2-[(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)amino]ethyl]-1-phenylmethanesulfonamide
CID 50947326
4-[6-[4-(2,6-dimethylpyrimidin-4-yl)piperazin-1-yl]-2-methylpyrimidin-4-yl]morpholine
CID 146078312
2-methyl-N-(2-methyl-6-propan-2-ylphenyl)-6-morpholin-4-ylpyrimidin-4-amine
CID 112869912
N-[2-[(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)amino]ethyl]pyridine-2-carboxamide
CID 122294062
4-[4-(2-methylpropyl)-6-morpholin-4-yl-2-pyridinyl]morpholine
CID 59292396
4-acetyl-N-[2-[(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)amino]ethyl]benzamide
CID 122294236
2-methyl-6-[4-(2-methylpropyl)piperazin-1-yl]-N-propylpyrimidin-4-amine
CID 80803337

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine?
The IUPAC name of 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine (CID 112868035) is 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine?
The canonical SMILES for 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine is Cc1nc(NCC(C)C)cc(N2CCOCC2)n1.
What is the InChIKey of 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine?
The InChIKey is FRGRRMMXDALJKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-10(2)9-14-12-8-13(16-11(3)15-12)17-4-6-18-7-5-17/h8,10H,4-7,9H2,1-3H3,(H,14,15,16).
What are the key properties of 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine?
2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine has a molecular weight of 250.35 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylpropyl)-6-morpholin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 112868035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).