[5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine

C15H24N6O — CID 68530635

IUPAC[5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCc1c(C)n(CCCN2CCOCC2)c2ncnc(NN)c12
InChIInChI=1S/C15H24N6O/c1-11-12(2)21(5-3-4-20-6-8-22-9-7-20)15-13(11)14(19-16)17-10-18-15/h10H,3-9,16H2,1-2H3,(H,17,18,19)
InChIKeyMLDAYAVMTHFOPT-UHFFFAOYSA-N
MW304.40 g/mol
LogP1.06
Rot. Bonds5

About [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine

[5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 68530635) has the molecular formula C15H24N6O and a molecular weight of 304.40 g/mol. Its IUPAC name is [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID68530635
Molecular FormulaC15H24N6O
Molecular Weight304.40 g/mol
Exact Mass304.20
IUPAC Name[5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCc1c(C)n(CCCN2CCOCC2)c2ncnc(NN)c12
InChIInChI=1S/C15H24N6O/c1-11-12(2)21(5-3-4-20-6-8-22-9-7-20)15-13(11)14(19-16)17-10-18-15/h10H,3-9,16H2,1-2H3,(H,17,18,19)
InChIKeyMLDAYAVMTHFOPT-UHFFFAOYSA-N
XLogP1.06
TPSA81.23 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-methyl-N-(3-morpholin-4-ylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 22590085
5,6-dimethyl-N-(2-morpholin-4-ylethyl)-7-phenylpyrrolo[2,3-d]pyrimidin-4-amine
CID 4909378
6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 66324992
N-[7-[3-(dimethylamino)propyl]-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-yl]-N',N'-dimethylethane-1,2-diamine
CID 4912729
3-[4-(butylamino)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-7-yl]propyl-dimethylazanium
CID 7641893
4-[2-[11,12-dimethyl-4-(2-methylphenyl)-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]ethyl]morpholine
CID 20898536
6-ethyl-N-(3-morpholin-4-ylpropyl)quinazolin-4-amine
CID 21002676
6-chloro-5-ethyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 63729586
2,6,7-trimethyl-1-(3-morpholin-4-ylpropyl)imidazo[4,5-c]pyridin-4-amine
CID 141069870
4-[3-(4,6-dichloropyrimidin-5-yl)propyl]morpholine
CID 170871352
5,6-dimethyl-7-(5-methylhexyl)pyrrolo[2,3-d]pyrimidin-4-amine
CID 115326743
N-(3-morpholin-4-ylpropyl)-9-phenylpurin-6-amine
CID 44726219

Frequently Asked Questions

What is the IUPAC name of [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine (CID 68530635) is [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine is Cc1c(C)n(CCCN2CCOCC2)c2ncnc(NN)c12.
What is the InChIKey of [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is MLDAYAVMTHFOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6O/c1-11-12(2)21(5-3-4-20-6-8-22-9-7-20)15-13(11)14(19-16)17-10-18-15/h10H,3-9,16H2,1-2H3,(H,17,18,19).
What are the key properties of [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine?
[5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 304.40 g/mol, XLogP of 1.06, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 68530635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).