N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine

C16H19N5 — CID 156730609

IUPACN-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine
SMILESCCn1ncc(Nc2ncc3cc(C)c(C)cc3n2)c1C
InChIInChI=1S/C16H19N5/c1-5-21-12(4)15(9-18-21)20-16-17-8-13-6-10(2)11(3)7-14(13)19-16/h6-9H,5H2,1-4H3,(H,17,19,20)
InChIKeyJTHPSOYOQRQCJJ-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.52
Rot. Bonds3

About N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine

N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine (PubChem CID 156730609) has the molecular formula C16H19N5 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine.

Molecular Properties

Compound NameN-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine
PubChem CID156730609
Molecular FormulaC16H19N5
Molecular Weight281.36 g/mol
Exact Mass281.16
IUPAC NameN-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine
SMILESCCn1ncc(Nc2ncc3cc(C)c(C)cc3n2)c1C
InChIInChI=1S/C16H19N5/c1-5-21-12(4)15(9-18-21)20-16-17-8-13-6-10(2)11(3)7-14(13)19-16/h6-9H,5H2,1-4H3,(H,17,19,20)
InChIKeyJTHPSOYOQRQCJJ-UHFFFAOYSA-N
XLogP3.52
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-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

N6,N6-dimethyl-N4-[1-(phenylmethyl)-5-indazolyl]pyrido[3,4-d]pyrimidine-4,6-diamine
CID 6603857
Ldn-212854
CID 60182388
Pyrazolo[1,5-b]pyridazine deriv. 37
CID 6539379
8-cyclopropyl-N-[5-methyl-1-(oxan-4-yl)-1H-pyrazol-4-yl]quinazolin-2-amine
CID 162394494
N-(4-propan-2-ylphenyl)-4-pyrazolo[1,5-b]pyridazin-3-ylpyrimidin-2-amine
CID 6539364
Pyrazolo[1,5-b]pyridazine deriv. 23
CID 6539365
N-(2-aminoethyl)-12-methyl-12,14,17-triazatetracyclo[8.7.0.0^{3,8}.0^{11,15}]heptadeca-1,3,5,7,9,11(15),13,16-octaen-16-amine
CID 9900652
N,12-dimethyl-14,15,17-triazatetracyclo[8.7.0.0^{3,8}.0^{11,15}]heptadeca-1,3,5,7,9,11,13,16-octaen-16-amine
CID 20767724
Methyl[2-({12-methyl-14,15,17-triazatetracyclo[8.7.0.0^{3,8}.0^{11,15}]heptadeca-1,3,5,7,9,11,13,16-octaen-16-yl}amino)ethyl]amine
CID 20767725
Aminoquinazoline, 19
CID 24863072
2-(1-methyl-1H-imidazol-2-yl)-8-(4-(1-methyl-1H-pyrazol-4-yl)phenyl)-1,6-naphthyridine
CID 118660604
1-(3-Fluorophenyl)-3-(3-((7-(1-methyl-1H-pyrazol-4-yl)quinazolin-4-yl)amino)phenyl)urea
CID 154573766

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine?
The IUPAC name of N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine (CID 156730609) is N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine.
What is the SMILES notation for N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine?
The canonical SMILES for N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine is CCn1ncc(Nc2ncc3cc(C)c(C)cc3n2)c1C.
What is the InChIKey of N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine?
The InChIKey is JTHPSOYOQRQCJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5/c1-5-21-12(4)15(9-18-21)20-16-17-8-13-6-10(2)11(3)7-14(13)19-16/h6-9H,5H2,1-4H3,(H,17,19,20).
What are the key properties of N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine?
N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine has a molecular weight of 281.36 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-5-methylpyrazol-4-yl)-6,7-dimethylquinazolin-2-amine is sourced from PubChem (CID 156730609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).