[(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium

C25H24FN8+ — CID 142605597

IUPAC[(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium
SMILESC[NH2+]N(/C=C(\N)c1ccc(-c2cccnc2)cc1)Cc1cn2c(N)nc3c(F)cccc3c2n1
InChIInChI=1S/C25H23FN8/c1-29-33(15-22(27)17-9-7-16(8-10-17)18-4-3-11-30-12-18)13-19-14-34-24(31-19)20-5-2-6-21(26)23(20)32-25(34)28/h2-12,14-15,29H,13,27H2,1H3,(H2,28,32)/p+1/b22-15-
InChIKeyMQRZXLRQUARBGU-JCMHNJIXSA-O
MW455.52 g/mol
LogP2.53
Rot. Bonds6

About [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium

[(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium (PubChem CID 142605597) has the molecular formula C25H24FN8+ and a molecular weight of 455.52 g/mol. Its IUPAC name is [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium.

Molecular Properties

Compound Name[(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium
PubChem CID142605597
Molecular FormulaC25H24FN8+
Molecular Weight455.52 g/mol
Exact Mass455.21
IUPAC Name[(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium
SMILESC[NH2+]N(/C=C(\N)c1ccc(-c2cccnc2)cc1)Cc1cn2c(N)nc3c(F)cccc3c2n1
InChIInChI=1S/C25H23FN8/c1-29-33(15-22(27)17-9-7-16(8-10-17)18-4-3-11-30-12-18)13-19-14-34-24(31-19)20-5-2-6-21(26)23(20)32-25(34)28/h2-12,14-15,29H,13,27H2,1H3,(H2,28,32)/p+1/b22-15-
InChIKeyMQRZXLRQUARBGU-JCMHNJIXSA-O
XLogP2.53
TPSA114.97 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500455.52
LogP ≤ 52.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium 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

2-[[3-(2,1,3-benzoxadiazol-5-yl)phenyl]methyl]-7-fluoroimidazo[1,2-c]quinazolin-5-amine
CID 138689322
7-fluoro-2-[(5-fluoro-1,3-dihydroisoindol-2-yl)methyl]imidazo[1,2-c]quinazolin-5-amine
CID 138689260
2-[(8-fluoro-2-pyridin-3-ylquinazolin-4-yl)amino]benzamide
CID 71273500
[4-[(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl]piperidin-1-yl]-(4-methoxy-2-pyridinyl)methanone
CID 138689604
3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050404
(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-4-[4-(4-methoxyphenyl)piperazin-1-yl]-2-(2-methylhydrazinyl)but-1-enyl]azanium
CID 142605581
1-[(2,6-difluorophenyl)methyl]-4-pyridin-3-ylpyrazolo[3,4-d]pyrimidin-6-amine
CID 172684570
3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine
CID 173227093
3-azulen-6-ylpyridine
CID 86232079
2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-pyridin-3-ylphenyl)naphthalen-1-yl]phenyl]-1,3,5-triazine
CID 165168483
(Z)-3-amino-2-(4-pyridin-3-ylphenyl)prop-2-enamide
CID 138698866
3-oxo-3-(4-pyridin-3-ylphenyl)propanoic acid
CID 170887253

Frequently Asked Questions

What is the IUPAC name of [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium?
The IUPAC name of [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium (CID 142605597) is [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium.
What is the SMILES notation for [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium?
The canonical SMILES for [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium is C[NH2+]N(/C=C(\N)c1ccc(-c2cccnc2)cc1)Cc1cn2c(N)nc3c(F)cccc3c2n1.
What is the InChIKey of [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium?
The InChIKey is MQRZXLRQUARBGU-JCMHNJIXSA-O. The full InChI is InChI=1S/C25H23FN8/c1-29-33(15-22(27)17-9-7-16(8-10-17)18-4-3-11-30-12-18)13-19-14-34-24(31-19)20-5-2-6-21(26)23(20)32-25(34)28/h2-12,14-15,29H,13,27H2,1H3,(H2,28,32)/p+1/b22-15-.
What are the key properties of [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium?
[(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium has a molecular weight of 455.52 g/mol, XLogP of 2.53, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl-[(Z)-2-amino-2-(4-pyridin-3-ylphenyl)ethenyl]amino]-methylazanium is sourced from PubChem (CID 142605597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).