(7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine

C13H15F2N3 — CID 62915501

IUPAC(7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine
SMILESCc1nc2c(F)c(F)ccc2c(NN)c1C(C)C
InChIInChI=1S/C13H15F2N3/c1-6(2)10-7(3)17-13-8(12(10)18-16)4-5-9(14)11(13)15/h4-6H,16H2,1-3H3,(H,17,18)
InChIKeyDVBKVFRZMWDIIB-UHFFFAOYSA-N
MW251.28 g/mol
LogP3.23
Rot. Bonds2

About (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine

(7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine (PubChem CID 62915501) has the molecular formula C13H15F2N3 and a molecular weight of 251.28 g/mol. Its IUPAC name is (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine
PubChem CID62915501
Molecular FormulaC13H15F2N3
Molecular Weight251.28 g/mol
Exact Mass251.12
IUPAC Name(7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine
SMILESCc1nc2c(F)c(F)ccc2c(NN)c1C(C)C
InChIInChI=1S/C13H15F2N3/c1-6(2)10-7(3)17-13-8(12(10)18-16)4-5-9(14)11(13)15/h4-6H,16H2,1-3H3,(H,17,18)
InChIKeyDVBKVFRZMWDIIB-UHFFFAOYSA-N
XLogP3.23
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

(5,6,8-trifluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine
CID 62915682
(2-ethyl-7,8-difluoro-3-methylquinolin-4-yl)hydrazine
CID 63554093
[2-methyl-3-propan-2-yl-8-(trifluoromethoxy)quinolin-4-yl]hydrazine
CID 63483517
N-ethyl-7,8-difluoro-2,3-dimethylquinolin-4-amine
CID 62197895
[8-(methoxymethyl)-2-methyl-3-propan-2-ylquinolin-4-yl]hydrazine
CID 62915681
(5-bromo-8-chloro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine
CID 63483898
(8-fluoro-2,3,5-trimethylquinolin-4-yl)hydrazine
CID 62252075
[2-(difluoromethyl)-7,8-difluoroquinolin-4-yl]hydrazine
CID 62890722
5,6,8-trifluoro-N,2-dimethyl-3-propan-2-ylquinolin-4-amine
CID 62915678
3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine
CID 175624755
N-ethyl-2-methyl-3-propan-2-ylbenzo[h]quinolin-4-amine
CID 63480758
(7,8-difluoro-3-propan-2-ylquinolin-2-yl)hydrazine
CID 63233124

Frequently Asked Questions

What is the IUPAC name of (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine?
The IUPAC name of (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine (CID 62915501) is (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine.
What is the SMILES notation for (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine?
The canonical SMILES for (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine is Cc1nc2c(F)c(F)ccc2c(NN)c1C(C)C.
What is the InChIKey of (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine?
The InChIKey is DVBKVFRZMWDIIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F2N3/c1-6(2)10-7(3)17-13-8(12(10)18-16)4-5-9(14)11(13)15/h4-6H,16H2,1-3H3,(H,17,18).
What are the key properties of (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine?
(7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine has a molecular weight of 251.28 g/mol, XLogP of 3.23, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7,8-difluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine is sourced from PubChem (CID 62915501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).