2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine

C16H26N4O — CID 80986418

IUPAC2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C2CC2)nc(N2CCOCC2C)c1C
InChIInChI=1S/C16H26N4O/c1-4-7-17-14-12(3)16(19-15(18-14)13-5-6-13)20-8-9-21-10-11(20)2/h11,13H,4-10H2,1-3H3,(H,17,18,19)
InChIKeyLWCNMQODZWGMEG-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.71
Rot. Bonds5

About 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine

2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine (PubChem CID 80986418) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine
PubChem CID80986418
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C2CC2)nc(N2CCOCC2C)c1C
InChIInChI=1S/C16H26N4O/c1-4-7-17-14-12(3)16(19-15(18-14)13-5-6-13)20-8-9-21-10-11(20)2/h11,13H,4-10H2,1-3H3,(H,17,18,19)
InChIKeyLWCNMQODZWGMEG-UHFFFAOYSA-N
XLogP2.71
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80986419
N-ethyl-5-methyl-6-(3-methylmorpholin-4-yl)-2-propylpyrimidin-4-amine
CID 80993713
2-cyclopropyl-6-(3-ethylmorpholin-4-yl)-N,5-dimethylpyrimidin-4-amine
CID 80993593
2-cyclopropyl-5-methyl-6-piperazin-1-yl-N-propylpyrimidin-4-amine
CID 80984339
2-cyclopropyl-N-ethyl-5-methyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine
CID 80984939
2-cyclopropyl-6-(3,3-dimethylmorpholin-4-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80986182
2-tert-butyl-5-methyl-6-(2-methylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
CID 80987881
2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine
CID 80992611
1-[2-cyclopropyl-5-methyl-6-(propylamino)pyrimidin-4-yl]-3-methylpyrrolidin-3-ol
CID 103358914
6-cyclobutyloxy-2-cyclopropyl-5-methyl-N-propylpyrimidin-4-amine
CID 80991023
2-cyclopropyl-6-hydrazinyl-5-methyl-N-propylpyrimidin-4-amine
CID 81000575
2-tert-butyl-N,5-dimethyl-6-(3-methylmorpholin-4-yl)pyrimidin-4-amine
CID 80993569

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine (CID 80986418) is 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine is CCCNc1nc(C2CC2)nc(N2CCOCC2C)c1C.
What is the InChIKey of 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine?
The InChIKey is LWCNMQODZWGMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-4-7-17-14-12(3)16(19-15(18-14)13-5-6-13)20-8-9-21-10-11(20)2/h11,13H,4-10H2,1-3H3,(H,17,18,19).
What are the key properties of 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine?
2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine has a molecular weight of 290.41 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-methyl-6-(3-methylmorpholin-4-yl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80986418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).