hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine

C20H26N6O — CID 69053002

IUPAChydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine
SMILESCc1cc2c(-c3ccc(OC4CCNCC4)c(C)c3)ncnc2cn1.NN
InChIInChI=1S/C20H22N4O.H4N2/c1-13-9-15(3-4-19(13)25-16-5-7-21-8-6-16)20-17-10-14(2)22-11-18(17)23-12-24-20;1-2/h3-4,9-12,16,21H,5-8H2,1-2H3;1-2H2
InChIKeyNCKJYAKRIPGGHU-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.26
Rot. Bonds3

About hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine

hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine (PubChem CID 69053002) has the molecular formula C20H26N6O and a molecular weight of 366.47 g/mol. Its IUPAC name is hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine.

Molecular Properties

Compound Namehydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine
PubChem CID69053002
Molecular FormulaC20H26N6O
Molecular Weight366.47 g/mol
Exact Mass366.22
IUPAC Namehydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine
SMILESCc1cc2c(-c3ccc(OC4CCNCC4)c(C)c3)ncnc2cn1.NN
InChIInChI=1S/C20H22N4O.H4N2/c1-13-9-15(3-4-19(13)25-16-5-7-21-8-6-16)20-17-10-14(2)22-11-18(17)23-12-24-20;1-2/h3-4,9-12,16,21H,5-8H2,1-2H3;1-2H2
InChIKeyNCKJYAKRIPGGHU-UHFFFAOYSA-N
XLogP2.26
TPSA111.97 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.26
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine?
The IUPAC name of hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine (CID 69053002) is hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine.
What is the SMILES notation for hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine?
The canonical SMILES for hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine is Cc1cc2c(-c3ccc(OC4CCNCC4)c(C)c3)ncnc2cn1.NN.
What is the InChIKey of hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine?
The InChIKey is NCKJYAKRIPGGHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O.H4N2/c1-13-9-15(3-4-19(13)25-16-5-7-21-8-6-16)20-17-10-14(2)22-11-18(17)23-12-24-20;1-2/h3-4,9-12,16,21H,5-8H2,1-2H3;1-2H2.
What are the key properties of hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine?
hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine has a molecular weight of 366.47 g/mol, XLogP of 2.26, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazine;6-methyl-4-(3-methyl-4-piperidin-4-yloxyphenyl)pyrido[3,4-d]pyrimidine is sourced from PubChem (CID 69053002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).