fluoromethane;4-methylquinazoline

C10H11FN2 — CID 91079443

IUPACfluoromethane;4-methylquinazoline
SMILESCF.Cc1ncnc2ccccc12
InChIInChI=1S/C9H8N2.CH3F/c1-7-8-4-2-3-5-9(8)11-6-10-7;1-2/h2-6H,1H3;1H3
InChIKeyRYBDHEHHQUDQKL-UHFFFAOYSA-N
MW178.21 g/mol
LogP2.52
Rot. Bonds

About fluoromethane;4-methylquinazoline

fluoromethane;4-methylquinazoline (PubChem CID 91079443) has the molecular formula C10H11FN2 and a molecular weight of 178.21 g/mol. Its IUPAC name is fluoromethane;4-methylquinazoline.

Molecular Properties

Compound Namefluoromethane;4-methylquinazoline
PubChem CID91079443
Molecular FormulaC10H11FN2
Molecular Weight178.21 g/mol
Exact Mass178.09
IUPAC Namefluoromethane;4-methylquinazoline
SMILESCF.Cc1ncnc2ccccc12
InChIInChI=1S/C9H8N2.CH3F/c1-7-8-4-2-3-5-9(8)11-6-10-7;1-2/h2-6H,1H3;1H3
InChIKeyRYBDHEHHQUDQKL-UHFFFAOYSA-N
XLogP2.52
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.21
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

benzene;4-methylquinazoline
CID 174274782
ethane;methanol;4-methylquinazoline
CID 91108480
2-chloro-N-methylacetamide;4-methylquinazoline
CID 91539258
4,6-dimethylquinazoline;ethane
CID 91475450
quinazolin-4-yl hypofluorite
CID 143671515
4-methylquinazolin-7-amine
CID 90920738
N,N-dimethylquinazolin-4-amine;hydrochloride
CID 174283261
azane;quinazolin-4-amine
CID 172800040
hydron;quinazolin-4-amine
CID 174478214
7-chloro-4-methylquinazoline;ethane
CID 142542904
4-ethoxyquinazoline
CID 589708
N-(2,4-dimethylphenyl)quinazolin-4-amine
CID 2806519

Frequently Asked Questions

What is the IUPAC name of fluoromethane;4-methylquinazoline?
The IUPAC name of fluoromethane;4-methylquinazoline (CID 91079443) is fluoromethane;4-methylquinazoline.
What is the SMILES notation for fluoromethane;4-methylquinazoline?
The canonical SMILES for fluoromethane;4-methylquinazoline is CF.Cc1ncnc2ccccc12.
What is the InChIKey of fluoromethane;4-methylquinazoline?
The InChIKey is RYBDHEHHQUDQKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2.CH3F/c1-7-8-4-2-3-5-9(8)11-6-10-7;1-2/h2-6H,1H3;1H3.
What are the key properties of fluoromethane;4-methylquinazoline?
fluoromethane;4-methylquinazoline has a molecular weight of 178.21 g/mol, XLogP of 2.52, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethane;4-methylquinazoline is sourced from PubChem (CID 91079443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).