N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine

C18H15N5 — CID 133387317

IUPACN-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine
SMILESCc1c(Nc2ncnc3ccccc23)cnn1-c1ccccc1
InChIInChI=1S/C18H15N5/c1-13-17(11-21-23(13)14-7-3-2-4-8-14)22-18-15-9-5-6-10-16(15)19-12-20-18/h2-12H,1H3,(H,19,20,22)
InChIKeySGEWFWBITIKUAN-UHFFFAOYSA-N
MW301.35 g/mol
LogP3.87
Rot. Bonds3

About N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine

N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine (PubChem CID 133387317) has the molecular formula C18H15N5 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine.

Molecular Properties

Compound NameN-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine
PubChem CID133387317
Molecular FormulaC18H15N5
Molecular Weight301.35 g/mol
Exact Mass301.13
IUPAC NameN-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine
SMILESCc1c(Nc2ncnc3ccccc23)cnn1-c1ccccc1
InChIInChI=1S/C18H15N5/c1-13-17(11-21-23(13)14-7-3-2-4-8-14)22-18-15-9-5-6-10-16(15)19-12-20-18/h2-12H,1H3,(H,19,20,22)
InChIKeySGEWFWBITIKUAN-UHFFFAOYSA-N
XLogP3.87
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-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

4-methyl-3-(quinazolin-4-ylamino)benzoic acid
CID 110434771
N-(2,4-dimethylphenyl)quinazolin-4-amine
CID 2806519
N-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine
CID 90988497
6,7-dimethyl-N-(2-methylphenyl)quinazolin-4-amine
CID 18685587
2-N-quinazolin-4-ylbenzene-1,2-diamine
CID 21190751
3-chloro-N-(5-methyl-1-phenylpyrazol-4-yl)-5-nitropyridin-2-amine
CID 133387375
4-methyl-2-(quinazolin-4-ylamino)phenol
CID 725411
N-(3-methylphenyl)quinazolin-4-amine
CID 659954
N-(2,5-dimethylpyrazol-3-yl)-4-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide
CID 23400195
N-(4-tert-butylphenyl)quinazolin-4-amine
CID 11323396
N-pyridin-3-ylquinazolin-4-amine
CID 5328017
4-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 23400178

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine?
The IUPAC name of N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine (CID 133387317) is N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine.
What is the SMILES notation for N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine?
The canonical SMILES for N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine is Cc1c(Nc2ncnc3ccccc23)cnn1-c1ccccc1.
What is the InChIKey of N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine?
The InChIKey is SGEWFWBITIKUAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5/c1-13-17(11-21-23(13)14-7-3-2-4-8-14)22-18-15-9-5-6-10-16(15)19-12-20-18/h2-12H,1H3,(H,19,20,22).
What are the key properties of N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine?
N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine has a molecular weight of 301.35 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1-phenylpyrazol-4-yl)quinazolin-4-amine is sourced from PubChem (CID 133387317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).