N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine

C14H14N6 — CID 80926650

IUPACN-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine
SMILESCc1cc(Nc2cccc3cccnc23)nc(NN)n1
InChIInChI=1S/C14H14N6/c1-9-8-12(19-14(17-9)20-15)18-11-6-2-4-10-5-3-7-16-13(10)11/h2-8H,15H2,1H3,(H2,17,18,19,20)
InChIKeyBJXCPNPDOCTTJC-UHFFFAOYSA-N
MW266.31 g/mol
LogP2.36
Rot. Bonds3

About N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine

N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine (PubChem CID 80926650) has the molecular formula C14H14N6 and a molecular weight of 266.31 g/mol. Its IUPAC name is N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine.

Molecular Properties

Compound NameN-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine
PubChem CID80926650
Molecular FormulaC14H14N6
Molecular Weight266.31 g/mol
Exact Mass266.13
IUPAC NameN-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine
SMILESCc1cc(Nc2cccc3cccnc23)nc(NN)n1
InChIInChI=1S/C14H14N6/c1-9-8-12(19-14(17-9)20-15)18-11-6-2-4-10-5-3-7-16-13(10)11/h2-8H,15H2,1H3,(H2,17,18,19,20)
InChIKeyBJXCPNPDOCTTJC-UHFFFAOYSA-N
XLogP2.36
TPSA88.75 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 52.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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

6-methyl-2-N-quinolin-8-yl-4-N-[2-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 112931278
2-N-(3-chlorophenyl)-6-methyl-4-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112929778
6-methyl-2-N-(3-methylbutyl)-4-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112925343
2-N-[2-(dimethylamino)ethyl]-6-methyl-4-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112913095
2-N-(2,5-dichlorophenyl)-6-methyl-4-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112932059
4-N-(2,4-difluorophenyl)-6-methyl-2-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112932073
6-methyl-4-N-(2-propan-2-yloxyphenyl)-2-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112931046
4-N-(3-fluorophenyl)-6-methyl-2-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112931870
4-N-(3-chlorophenyl)-6-methyl-2-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112929729
2-N-[(4-methoxyphenyl)methyl]-6-methyl-4-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112918650
6-methyl-2-N-(4-pyrrolidin-1-ylphenyl)-4-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112931777
6-methyl-4-N-(4-propan-2-yloxyphenyl)-2-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112931098

Frequently Asked Questions

What is the IUPAC name of N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine?
The IUPAC name of N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine (CID 80926650) is N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine.
What is the SMILES notation for N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine?
The canonical SMILES for N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine is Cc1cc(Nc2cccc3cccnc23)nc(NN)n1.
What is the InChIKey of N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine?
The InChIKey is BJXCPNPDOCTTJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6/c1-9-8-12(19-14(17-9)20-15)18-11-6-2-4-10-5-3-7-16-13(10)11/h2-8H,15H2,1H3,(H2,17,18,19,20).
What are the key properties of N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine?
N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine has a molecular weight of 266.31 g/mol, XLogP of 2.36, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydrazinyl-6-methylpyrimidin-4-yl)quinolin-8-amine is sourced from PubChem (CID 80926650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).