N-ethylquinazolin-4-amine;fluorobenzene

C16H16FN3 — CID 174725840

IUPACN-ethylquinazolin-4-amine;fluorobenzene
SMILESCCNc1ncnc2ccccc12.Fc1ccccc1
InChIInChI=1S/C10H11N3.C6H5F/c1-2-11-10-8-5-3-4-6-9(8)12-7-13-10;7-6-4-2-1-3-5-6/h3-7H,2H2,1H3,(H,11,12,13);1-5H
InChIKeyNLVJGJUDFQCCBS-UHFFFAOYSA-N
MW269.32 g/mol
LogP3.89
Rot. Bonds2

About N-ethylquinazolin-4-amine;fluorobenzene

N-ethylquinazolin-4-amine;fluorobenzene (PubChem CID 174725840) has the molecular formula C16H16FN3 and a molecular weight of 269.32 g/mol. Its IUPAC name is N-ethylquinazolin-4-amine;fluorobenzene.

Molecular Properties

Compound NameN-ethylquinazolin-4-amine;fluorobenzene
PubChem CID174725840
Molecular FormulaC16H16FN3
Molecular Weight269.32 g/mol
Exact Mass269.13
IUPAC NameN-ethylquinazolin-4-amine;fluorobenzene
SMILESCCNc1ncnc2ccccc12.Fc1ccccc1
InChIInChI=1S/C10H11N3.C6H5F/c1-2-11-10-8-5-3-4-6-9(8)12-7-13-10;7-6-4-2-1-3-5-6/h3-7H,2H2,1H3,(H,11,12,13);1-5H
InChIKeyNLVJGJUDFQCCBS-UHFFFAOYSA-N
XLogP3.89
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.32
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethylquinazolin-4-amine;fluorobenzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-ethyl-1-N-quinazolin-4-ylpentane-1,2-diamine
CID 106286875
N-[(2,5-difluorophenyl)methyl]quinazolin-4-amine
CID 63373228
2-[(quinazolin-4-ylamino)methyl]butanoic acid
CID 65226835
N'-ethyl-N'-propan-2-yl-N-quinazolin-4-ylethane-1,2-diamine
CID 133275480
2-methyl-1-(quinazolin-4-ylamino)pentan-2-ol
CID 113234742
N-[2-(4-phenylphenoxy)propyl]quinazolin-4-amine
CID 20545319
3-methyl-1-(quinazolin-4-ylamino)butan-2-ol
CID 113240545
(1S)-1-phenyl-2-(quinazolin-4-ylamino)ethanol
CID 93317181
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]quinazolin-4-amine
CID 86768011
(1R)-1-(2-fluorophenyl)-2-(quinazolin-4-ylamino)ethanol
CID 94817432
2-methyl-4-(quinazolin-4-ylamino)butanoic acid
CID 80539709
N-propyl-2-(quinazolin-4-ylamino)acetamide
CID 39165546

Frequently Asked Questions

What is the IUPAC name of N-ethylquinazolin-4-amine;fluorobenzene?
The IUPAC name of N-ethylquinazolin-4-amine;fluorobenzene (CID 174725840) is N-ethylquinazolin-4-amine;fluorobenzene.
What is the SMILES notation for N-ethylquinazolin-4-amine;fluorobenzene?
The canonical SMILES for N-ethylquinazolin-4-amine;fluorobenzene is CCNc1ncnc2ccccc12.Fc1ccccc1.
What is the InChIKey of N-ethylquinazolin-4-amine;fluorobenzene?
The InChIKey is NLVJGJUDFQCCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3.C6H5F/c1-2-11-10-8-5-3-4-6-9(8)12-7-13-10;7-6-4-2-1-3-5-6/h3-7H,2H2,1H3,(H,11,12,13);1-5H.
What are the key properties of N-ethylquinazolin-4-amine;fluorobenzene?
N-ethylquinazolin-4-amine;fluorobenzene has a molecular weight of 269.32 g/mol, XLogP of 3.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylquinazolin-4-amine;fluorobenzene is sourced from PubChem (CID 174725840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).