4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine

C19H25N5O — CID 112909374

IUPAC4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine
SMILESCc1cc(N2CCCC2)nc(Nc2ccccc2N2CCOCC2)n1
InChIInChI=1S/C19H25N5O/c1-15-14-18(24-8-4-5-9-24)22-19(20-15)21-16-6-2-3-7-17(16)23-10-12-25-13-11-23/h2-3,6-7,14H,4-5,8-13H2,1H3,(H,20,21,22)
InChIKeyFXMMSQPYGMVUGY-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.97
Rot. Bonds4

About 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine

4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine (PubChem CID 112909374) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine
PubChem CID112909374
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine
SMILESCc1cc(N2CCCC2)nc(Nc2ccccc2N2CCOCC2)n1
InChIInChI=1S/C19H25N5O/c1-15-14-18(24-8-4-5-9-24)22-19(20-15)21-16-6-2-3-7-17(16)23-10-12-25-13-11-23/h2-3,6-7,14H,4-5,8-13H2,1H3,(H,20,21,22)
InChIKeyFXMMSQPYGMVUGY-UHFFFAOYSA-N
XLogP2.97
TPSA53.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-methyl-N-(2-methylphenyl)-6-morpholin-4-ylpyrimidin-2-amine
CID 112912131
4-N-cyclopropyl-6-methyl-2-N-(2-morpholin-4-ylphenyl)pyrimidine-2,4-diamine
CID 112907508
2-N-(2,4-dimethylphenyl)-6-methyl-4-N-(2-morpholin-4-ylphenyl)pyrimidine-2,4-diamine
CID 112928044
4-N-ethyl-6-methyl-2-N-(2-morpholin-4-ylphenyl)-4-N-phenylpyrimidine-2,4-diamine
CID 112928805
4-N-[3-(dimethylamino)propyl]-6-methyl-2-N-(2-morpholin-4-ylphenyl)pyrimidine-2,4-diamine
CID 112913560
4-(azepan-1-yl)-N-(2,6-dimethylphenyl)-6-methylpyrimidin-2-amine
CID 112926580
6-methyl-4-N-(2-morpholin-4-ylphenyl)-2-N-propylpyrimidine-2,4-diamine
CID 112907068
6-(azepan-1-yl)-N-(2-morpholin-4-ylphenyl)pyrimidin-4-amine
CID 112864664
N-(2,4-dimethoxyphenyl)-4-methyl-6-morpholin-4-ylpyrimidin-2-amine
CID 112912177
N-(2,5-dimethylphenyl)-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine
CID 112909317
N-(2-chlorophenyl)-4-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 112913869
4-[6-methyl-2-(2-methylanilino)pyrimidin-4-yl]piperazine-1-carbaldehyde
CID 112914538

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine?
The IUPAC name of 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine (CID 112909374) is 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine?
The canonical SMILES for 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine is Cc1cc(N2CCCC2)nc(Nc2ccccc2N2CCOCC2)n1.
What is the InChIKey of 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine?
The InChIKey is FXMMSQPYGMVUGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-15-14-18(24-8-4-5-9-24)22-19(20-15)21-16-6-2-3-7-17(16)23-10-12-25-13-11-23/h2-3,6-7,14H,4-5,8-13H2,1H3,(H,20,21,22).
What are the key properties of 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine?
4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine has a molecular weight of 339.44 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-morpholin-4-ylphenyl)-6-pyrrolidin-1-ylpyrimidin-2-amine is sourced from PubChem (CID 112909374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).