N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine

C19H23N7 — CID 126895705

IUPACN,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine
SMILESCc1ccc(N2CCN(c3ccc4ncnc(N(C)C)c4c3)CC2)nn1
InChIInChI=1S/C19H23N7/c1-14-4-7-18(23-22-14)26-10-8-25(9-11-26)15-5-6-17-16(12-15)19(24(2)3)21-13-20-17/h4-7,12-13H,8-11H2,1-3H3
InChIKeyBYKPOKLPBKCLBZ-UHFFFAOYSA-N
MW349.44 g/mol
LogP2.12
Rot. Bonds3

About N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine

N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine (PubChem CID 126895705) has the molecular formula C19H23N7 and a molecular weight of 349.44 g/mol. Its IUPAC name is N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine
PubChem CID126895705
Molecular FormulaC19H23N7
Molecular Weight349.44 g/mol
Exact Mass349.20
IUPAC NameN,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine
SMILESCc1ccc(N2CCN(c3ccc4ncnc(N(C)C)c4c3)CC2)nn1
InChIInChI=1S/C19H23N7/c1-14-4-7-18(23-22-14)26-10-8-25(9-11-26)15-5-6-17-16(12-15)19(24(2)3)21-13-20-17/h4-7,12-13H,8-11H2,1-3H3
InChIKeyBYKPOKLPBKCLBZ-UHFFFAOYSA-N
XLogP2.12
TPSA61.28 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

N,N-dimethyl-6-(4-pyrimidin-4-ylpiperazin-1-yl)quinazolin-4-amine
CID 126895928
6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-4-propan-2-yloxyquinazoline
CID 126895043
N,N-dimethyl-6-[4-[6-(1,2,4-triazol-1-yl)pyrazin-2-yl]piperazin-1-yl]quinazolin-4-amine
CID 126895943
6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-4-(oxolan-3-yloxy)quinazoline
CID 126896635
N,N-dimethyl-6-[4-[2-(4-methylpyrazol-1-yl)ethyl]piperazin-1-yl]quinazolin-4-amine
CID 126895875
N,N-dimethyl-6-[4-[(5-methyl-1,3-oxazol-4-yl)methyl]piperazin-1-yl]quinazolin-4-amine
CID 126895844
2-[4-[4-(dimethylamino)quinazolin-6-yl]piperazin-1-yl]pyridine-3-carbonitrile
CID 126895692
N,N-dimethyl-6-[4-[2-(1,4-oxazepan-4-yl)ethyl]piperazin-1-yl]quinazolin-4-amine
CID 126895886
N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine
CID 126895716
3-[[4-[4-(dimethylamino)quinazolin-6-yl]piperazin-1-yl]methyl]-N,N-dimethyl-1,2,4-thiadiazol-5-amine
CID 126895764
6-[4-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-N,N-dimethylquinazolin-4-amine
CID 126895937
7-[[4-[4-(dimethylamino)quinazolin-6-yl]piperazin-1-yl]methyl]azepan-2-one
CID 126895768

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine?
The IUPAC name of N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine (CID 126895705) is N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine.
What is the SMILES notation for N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine?
The canonical SMILES for N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine is Cc1ccc(N2CCN(c3ccc4ncnc(N(C)C)c4c3)CC2)nn1.
What is the InChIKey of N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine?
The InChIKey is BYKPOKLPBKCLBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7/c1-14-4-7-18(23-22-14)26-10-8-25(9-11-26)15-5-6-17-16(12-15)19(24(2)3)21-13-20-17/h4-7,12-13H,8-11H2,1-3H3.
What are the key properties of N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine?
N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine has a molecular weight of 349.44 g/mol, XLogP of 2.12, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-amine is sourced from PubChem (CID 126895705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).