4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine

C22H26N8 — CID 154939051

IUPAC4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine
SMILESCc1cc2cnc(Nc3ccc(N4CCNCC4)cn3)nc2c2c1cnn2C(C)C
InChIInChI=1S/C22H26N8/c1-14(2)30-21-18(13-26-30)15(3)10-16-11-25-22(28-20(16)21)27-19-5-4-17(12-24-19)29-8-6-23-7-9-29/h4-5,10-14,23H,6-9H2,1-3H3,(H,24,25,27,28)
InChIKeyCUWYDPRQQOICRV-UHFFFAOYSA-N
MW402.51 g/mol
LogP3.42
Rot. Bonds4

About 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine

4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine (PubChem CID 154939051) has the molecular formula C22H26N8 and a molecular weight of 402.51 g/mol. Its IUPAC name is 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine.

Molecular Properties

Compound Name4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine
PubChem CID154939051
Molecular FormulaC22H26N8
Molecular Weight402.51 g/mol
Exact Mass402.23
IUPAC Name4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine
SMILESCc1cc2cnc(Nc3ccc(N4CCNCC4)cn3)nc2c2c1cnn2C(C)C
InChIInChI=1S/C22H26N8/c1-14(2)30-21-18(13-26-30)15(3)10-16-11-25-22(28-20(16)21)27-19-5-4-17(12-24-19)29-8-6-23-7-9-29/h4-5,10-14,23H,6-9H2,1-3H3,(H,24,25,27,28)
InChIKeyCUWYDPRQQOICRV-UHFFFAOYSA-N
XLogP3.42
TPSA83.79 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.51
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine with MolForge

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Launch Full Analysis

Related Compounds

1-[8-[[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]amino]-1-propan-2-ylpyrazolo[4,3-h]quinazolin-4-yl]ethanone;1-[8-[(4-fluoro-5-piperazin-1-yl-2-pyridinyl)amino]-1-propan-2-ylpyrazolo[4,3-h]quinazolin-4-yl]ethanone;1-[8-[[5-(4-methylpiperazin-1-yl)-2-pyridinyl]amino]-1-propan-2-ylpyrazolo[4,3-h]quinazolin-4-yl]ethanone;hydrochloride
CID 165048145
N-(4-methyl-5-piperazin-1-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine
CID 167605316
N-(5-piperidin-1-yl-2-pyridinyl)-1-propan-2-ylimidazo[4,5-h]quinazolin-8-amine
CID 146359752
5-bromo-2-N-(5-piperazin-1-yl-2-pyridinyl)pyrimidine-2,4-diamine
CID 68899926
1-[8-[[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]amino]-1-propan-2-ylpyrazolo[4,3-h]quinazolin-4-yl]ethanone;1-[8-[(4-fluoro-5-piperazin-1-yl-2-pyridinyl)amino]-1-propan-2-ylpyrazolo[4,3-h]quinazolin-4-yl]ethanone;4-(3-methoxy-5-methylphenyl)-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,3-h]quinazolin-8-amine;1-[8-[[5-(4-methylpiperazin-1-yl)-2-pyridinyl]amino]-1-propan-2-ylpyrazolo[4,3-h]quinazolin-4-yl]ethanone;1-[8-[(5-morpholin-4-yl-2-pyridinyl)amino]-1-propan-2-ylpyrazolo[4,3-h]quinazolin-4-yl]ethanone;dihydrochloride
CID 165047033
1-[6-[(1-propan-2-yltriazolo[4,5-h]quinazolin-8-yl)amino]-3-pyridinyl]piperazin-2-one;hydrochloride
CID 163286427
(2S)-1-[5-[(5-piperazin-1-yl-2-pyridinyl)amino]-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-8-yl]propan-2-ol
CID 58299780
8-cyclopentyl-10-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-amine
CID 58300068
8-cyclopentyl-6-(2-methylpropoxy)-2-[(5-piperazin-1-yl-2-pyridinyl)amino]pyrido[2,3-d]pyrimidin-7-one;hydrochloride
CID 10152333
(5E)-6-methyl-10-(2-methylpropyl)-2-[(5-piperazin-1-yl-2-pyridinyl)amino]-8,9,10,11-tetrahydropyrimido[4,5-e]azonin-7-one
CID 163893535
4-amino-2-[(5-piperazin-1-yl-2-pyridinyl)amino]pyrimidine-5-carbonitrile
CID 10063148
5-fluoro-4-(8-fluoro-1-methyl-4-propan-2-yl-2,3-dihydroquinoxalin-6-yl)-N-(5-piperazin-1-yl-2-pyridinyl)pyrimidin-2-amine
CID 166121076

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine?
The IUPAC name of 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine (CID 154939051) is 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine.
What is the SMILES notation for 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine?
The canonical SMILES for 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine is Cc1cc2cnc(Nc3ccc(N4CCNCC4)cn3)nc2c2c1cnn2C(C)C.
What is the InChIKey of 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine?
The InChIKey is CUWYDPRQQOICRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N8/c1-14(2)30-21-18(13-26-30)15(3)10-16-11-25-22(28-20(16)21)27-19-5-4-17(12-24-19)29-8-6-23-7-9-29/h4-5,10-14,23H,6-9H2,1-3H3,(H,24,25,27,28).
What are the key properties of 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine?
4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine has a molecular weight of 402.51 g/mol, XLogP of 3.42, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1-propan-2-ylpyrazolo[4,5-h]quinazolin-8-amine is sourced from PubChem (CID 154939051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).