7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine

C16H14FN3O — CID 59242088

IUPAC7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine
SMILESCOc1ccc(N(C)c2nncc3ccc(F)cc23)cc1
InChIInChI=1S/C16H14FN3O/c1-20(13-5-7-14(21-2)8-6-13)16-15-9-12(17)4-3-11(15)10-18-19-16/h3-10H,1-2H3
InChIKeyWQNFLJMCVQYTNC-UHFFFAOYSA-N
MW283.31 g/mol
LogP3.55
Rot. Bonds3

About 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine

7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine (PubChem CID 59242088) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine.

Molecular Properties

Compound Name7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine
PubChem CID59242088
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC Name7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine
SMILESCOc1ccc(N(C)c2nncc3ccc(F)cc23)cc1
InChIInChI=1S/C16H14FN3O/c1-20(13-5-7-14(21-2)8-6-13)16-15-9-12(17)4-3-11(15)10-18-19-16/h3-10H,1-2H3
InChIKeyWQNFLJMCVQYTNC-UHFFFAOYSA-N
XLogP3.55
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine 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

N-(4-methoxyphenyl)-4-methylphthalazin-1-amine
CID 3124064
1-(4-Methoxyphenyl)-3-(phthalazin-1-ylamino)thiourea
CID 134141630
1-Isoquinolinamine, N-(4-methoxyphenyl)-N-methyl-
CID 11300052
N-(4-phenoxyphenyl)phthalazin-1-amine;hydrochloride
CID 44531039
N-(4-methoxyphenyl)-N-methyl-4-phenylphthalazin-1-amine
CID 71540053
4-(4-methoxyphenyl)-N-methyl-N-(4-methylphenyl)phthalazin-1-amine
CID 71541705
N-(4-methoxyphenyl)-4-phenylphthalazin-1-amine
CID 2869439
4-[1-(4-Methoxyanilino)phthalazin-5-yl]phenol
CID 136042273
N-(4-methoxyphenyl)-4-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]phthalazin-1-amine
CID 164620715
N-(4-(chlorodifluoromethoxy)phenyl)-4-phenylphthalazin-1-amine
CID 5292026
4-(Phthalazinylamino)phenol
CID 4131718
4-Phthalazin-1-yl-piperazine-1-carboxylic acid (4-phenoxy-phenyl)-amide
CID 11464443

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine?
The IUPAC name of 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine (CID 59242088) is 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine.
What is the SMILES notation for 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine?
The canonical SMILES for 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine is COc1ccc(N(C)c2nncc3ccc(F)cc23)cc1.
What is the InChIKey of 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine?
The InChIKey is WQNFLJMCVQYTNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c1-20(13-5-7-14(21-2)8-6-13)16-15-9-12(17)4-3-11(15)10-18-19-16/h3-10H,1-2H3.
What are the key properties of 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine?
7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine has a molecular weight of 283.31 g/mol, XLogP of 3.55, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N-(4-methoxyphenyl)-N-methylphthalazin-1-amine is sourced from PubChem (CID 59242088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).