[6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine

C15H19N5 — CID 94672776

IUPAC[6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine
SMILESCc1ccc(-c2cc(NN)nc(N3CCCC3)n2)cc1
InChIInChI=1S/C15H19N5/c1-11-4-6-12(7-5-11)13-10-14(19-16)18-15(17-13)20-8-2-3-9-20/h4-7,10H,2-3,8-9,16H2,1H3,(H,17,18,19)
InChIKeyLAEVVUAQVPHLTO-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.34
Rot. Bonds3

About [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine

[6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine (PubChem CID 94672776) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine
PubChem CID94672776
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name[6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine
SMILESCc1ccc(-c2cc(NN)nc(N3CCCC3)n2)cc1
InChIInChI=1S/C15H19N5/c1-11-4-6-12(7-5-11)13-10-14(19-16)18-15(17-13)20-8-2-3-9-20/h4-7,10H,2-3,8-9,16H2,1H3,(H,17,18,19)
InChIKeyLAEVVUAQVPHLTO-UHFFFAOYSA-N
XLogP2.34
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

N-methyl-6-phenyl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 62192650
[2-(azepan-1-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62250697
[2-(4-methylpiperazin-1-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-yl]hydrazine
CID 106716175
4-(4-methylphenyl)-2-piperidin-1-ylpyrimidine
CID 51371027
N-(2-methylpropyl)-6-phenyl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 112933703
N-pentyl-6-phenyl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 112934269
N',N'-dimethyl-N-(6-phenyl-2-piperidin-1-ylpyrimidin-4-yl)ethane-1,2-diamine
CID 112934570
N-(4-methoxyphenyl)-6-phenyl-2-piperidin-1-ylpyrimidin-4-amine
CID 112934626
[6-(4-methylphenyl)-2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]methanamine
CID 28904443
CID 46855759
CID 46855759
N-[(2-methoxyphenyl)methyl]-6-phenyl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 112934233
2-[4-(3-methylphenyl)piperazin-1-yl]-6-phenyl-N-propan-2-ylpyrimidin-4-amine
CID 112932695

Frequently Asked Questions

What is the IUPAC name of [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine (CID 94672776) is [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine is Cc1ccc(-c2cc(NN)nc(N3CCCC3)n2)cc1.
What is the InChIKey of [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine?
The InChIKey is LAEVVUAQVPHLTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-11-4-6-12(7-5-11)13-10-14(19-16)18-15(17-13)20-8-2-3-9-20/h4-7,10H,2-3,8-9,16H2,1H3,(H,17,18,19).
What are the key properties of [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine?
[6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine has a molecular weight of 269.35 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 94672776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).