N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline

C19H20N4 — CID 656199

IUPACN,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline
SMILESCc1cc2n(n1)C(c1ccc(N(C)C)cc1)Nc1ccccc1-2
InChIInChI=1S/C19H20N4/c1-13-12-18-16-6-4-5-7-17(16)20-19(23(18)21-13)14-8-10-15(11-9-14)22(2)3/h4-12,19-20H,1-3H3
InChIKeyHIBWKMQYVONBLF-UHFFFAOYSA-N
MW304.40 g/mol
LogP3.90
Rot. Bonds2

About N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline

N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline (PubChem CID 656199) has the molecular formula C19H20N4 and a molecular weight of 304.40 g/mol. Its IUPAC name is N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline.

Molecular Properties

Compound NameN,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline
PubChem CID656199
Molecular FormulaC19H20N4
Molecular Weight304.40 g/mol
Exact Mass304.17
IUPAC NameN,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline
SMILESCc1cc2n(n1)C(c1ccc(N(C)C)cc1)Nc1ccccc1-2
InChIInChI=1S/C19H20N4/c1-13-12-18-16-6-4-5-7-17(16)20-19(23(18)21-13)14-8-10-15(11-9-14)22(2)3/h4-12,19-20H,1-3H3
InChIKeyHIBWKMQYVONBLF-UHFFFAOYSA-N
XLogP3.90
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-p-Tolyl-6H-pyrazolo[1,5-c]quinazolin-5-one
CID 135504122
2-Methyl-5-phenyl-3,5-dihydropyrazolo[1,5-c]quinazoline
CID 646753
5-(2-Chlorophenyl)-2-methyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 652880
5-[4-(4-methylpiperazino)phenyl]-N-phenyl-1H-pyrazole-1-carboxamide
CID 4264966
3-ethyl-1-phenyl-6-(piperazin-1-yl)-1H-indazole
CID 56670165
3-Ethyl-6-(3-methylpiperazin-1-yl)-1-phenylindazole
CID 56683649
2-Methyl-5-(3-methyl-1-phenyl-1H-pyrazol-4-yl)-5,6-dihydro-pyrazolo[1,5-c]quinazoline
CID 651250
2-Methyl-5-(4-methylsulfanyl-phenyl)-5,6-dihydro-pyrazolo[1,5-c]quinazoline
CID 655277
N-[4-(2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenyl]acetamide
CID 3158722
2,7-Dimethyl-5-(3-methyl-1-phenyl-4-pyrazolyl)-3,5-dihydropyrazolo[1,5-c]quinazoline
CID 3488511
2-(2-Fluoro-phenyl)-6H-pyrazolo[1,5-c]quinazolin-5-one
CID 135504131
2-Phenylpyrazolo[1,5-C]quinazolin-5(6H)-one
CID 135536664

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline?
The IUPAC name of N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline (CID 656199) is N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline.
What is the SMILES notation for N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline?
The canonical SMILES for N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline is Cc1cc2n(n1)C(c1ccc(N(C)C)cc1)Nc1ccccc1-2.
What is the InChIKey of N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline?
The InChIKey is HIBWKMQYVONBLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4/c1-13-12-18-16-6-4-5-7-17(16)20-19(23(18)21-13)14-8-10-15(11-9-14)22(2)3/h4-12,19-20H,1-3H3.
What are the key properties of N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline?
N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline has a molecular weight of 304.40 g/mol, XLogP of 3.90, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline is sourced from PubChem (CID 656199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).