1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine

C15H17N5 — CID 122208510

IUPAC1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine
SMILESCN(C)Nc1ncnc2c1cc(-c1ccccc1)n2C
InChIInChI=1S/C15H17N5/c1-19(2)18-14-12-9-13(11-7-5-4-6-8-11)20(3)15(12)17-10-16-14/h4-10H,1-3H3,(H,16,17,18)
InChIKeyBINDJKFCEIAFAI-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.52
Rot. Bonds3

About 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine

1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine (PubChem CID 122208510) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine
PubChem CID122208510
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC Name1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine
SMILESCN(C)Nc1ncnc2c1cc(-c1ccccc1)n2C
InChIInChI=1S/C15H17N5/c1-19(2)18-14-12-9-13(11-7-5-4-6-8-11)20(3)15(12)17-10-16-14/h4-10H,1-3H3,(H,16,17,18)
InChIKeyBINDJKFCEIAFAI-UHFFFAOYSA-N
XLogP2.52
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4,7-dimethyl-6-phenylpyrrolo[2,3-d]pyrimidine
CID 144850967
7-methyl-6-(4-methylphenyl)-N-[(4-methylphenyl)methyl]pyrrolo[2,3-d]pyrimidin-4-amine
CID 143080870
2,4-dichloro-7-methyl-6-phenylpyrrolo[2,3-d]pyrimidine
CID 164900032
2,6-dimethyl-3,7-diphenyl-2,6-naphthyridine-1,5-dione
CID 139056191
4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine
CID 19145545
7-methyl-4-phenylpyrrolo[2,3-d]pyrimidine-6-carboxylic acid
CID 82375479
N-methyl-4-(7-methyl-4-piperidin-1-ylpyrrolo[2,3-d]pyrimidin-6-yl)aniline
CID 172623602
6-dimethylphosphoryl-7-methyl-4-phenylpyrrolo[2,3-d]pyrimidine
CID 168867616
N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine
CID 4882445
N-(2-chlorophenyl)-3-methyltriazolo[4,5-d]pyrimidin-7-amine
CID 7688242
2-N-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)-1-N-phenylbenzene-1,2-diamine
CID 4975424
1-[2-(3,4-dihydroxypyrrolidin-1-yl)-7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl]pyrrolidine-3,4-diol
CID 67795133

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine?
The IUPAC name of 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine (CID 122208510) is 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine.
What is the SMILES notation for 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine?
The canonical SMILES for 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine is CN(C)Nc1ncnc2c1cc(-c1ccccc1)n2C.
What is the InChIKey of 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine?
The InChIKey is BINDJKFCEIAFAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-19(2)18-14-12-9-13(11-7-5-4-6-8-11)20(3)15(12)17-10-16-14/h4-10H,1-3H3,(H,16,17,18).
What are the key properties of 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine?
1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine has a molecular weight of 267.34 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-2-(7-methyl-6-phenylpyrrolo[2,3-d]pyrimidin-4-yl)hydrazine is sourced from PubChem (CID 122208510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).