N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide

C25H27BrN10 — CID 5469560

IUPACN-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
SMILESBr.C(=Cc1ccc(-c2cn3cc(C=CC=NNC4=NCCN4)ccc3n2)cc1)C=NNC1=NCCN1
InChIInChI=1S/C25H26N10.BrH/c1(11-30-33-24-26-13-14-27-24)3-19-5-8-21(9-6-19)22-18-35-17-20(7-10-23(35)32-22)4-2-12-31-34-25-28-15-16-29-25;/h1-12,17-18H,13-16H2,(H2,26,27,33)(H2,28,29,34);1H
InChIKeyFEUVWDUYZKJBEG-UHFFFAOYSA-N
MW547.47 g/mol
LogP2.67
Rot. Bonds7

About N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide

N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide (PubChem CID 5469560) has the molecular formula C25H27BrN10 and a molecular weight of 547.47 g/mol. Its IUPAC name is N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide.

Molecular Properties

Compound NameN-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
PubChem CID5469560
Molecular FormulaC25H27BrN10
Molecular Weight547.47 g/mol
Exact Mass546.16
IUPAC NameN-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
SMILESBr.C(=Cc1ccc(-c2cn3cc(C=CC=NNC4=NCCN4)ccc3n2)cc1)C=NNC1=NCCN1
InChIInChI=1S/C25H26N10.BrH/c1(11-30-33-24-26-13-14-27-24)3-19-5-8-21(9-6-19)22-18-35-17-20(7-10-23(35)32-22)4-2-12-31-34-25-28-15-16-29-25;/h1-12,17-18H,13-16H2,(H2,26,27,33)(H2,28,29,34);1H
InChIKeyFEUVWDUYZKJBEG-UHFFFAOYSA-N
XLogP2.67
TPSA114.86 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500547.47
LogP ≤ 52.67
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide with MolForge

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Related Compounds

N-[(E)-[(E)-3-[4-[6-[(Z,3E)-3-(1,4,5,6-tetrahydropyrimidin-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylidene]amino]-1,4,5,6-tetrahydropyrimidin-2-amine;hydrobromide
CID 54608530
(Z)-3-[4-[6-[(Z)-3-oxoprop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enal
CID 99726261
N-[(E)-[2-[(E)-(1,4,5,6-tetrahydropyrimidin-2-ylhydrazinylidene)methyl]imidazo[1,2-a]pyridin-6-yl]methylideneamino]-1,4,5,6-tetrahydropyrimidin-2-amine
CID 10570921
N-[(E)-[(2Z)-2-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)ethylidene]amino]-4,5-dihydro-1H-imidazol-2-amine
CID 98561244
6-(4,5-dihydro-1H-imidazol-2-yl)-2-phenylimidazo[1,2-a]pyridine;dihydrochloride
CID 172894357
N-[(E)-[4-(4,5-dihydro-1H-imidazol-2-ylmethyliminomethyl)phenyl]methylideneamino]-4,5-dihydro-1H-imidazol-2-amine
CID 172918425
[(E)-3-[4-[6-[(E)-3-azaniumylidene-3-ethoxyprop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]-1-ethoxyprop-2-enylidene]azanium dichloride
CID 135406530
2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-7-methylimidazo[1,2-a]pyridine
CID 57163774
(E)-3-[4-[6-[(E)-3-imino-3-(4-methylpiperazin-1-yl)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]-1-(4-methylpiperazin-1-yl)prop-2-en-1-imine
CID 10577217
N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]formamide
CID 24994442
N-[(E)-pyridin-3-ylmethylideneamino]-4,5-dihydro-1H-imidazol-2-amine
CID 5338079
2-[(E)-2-(4-imidazo[1,2-a]pyridin-2-ylphenyl)ethenyl]-4,5-dihydro-1,3-thiazole
CID 852426

Frequently Asked Questions

What is the IUPAC name of N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
The IUPAC name of N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide (CID 5469560) is N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide.
What is the SMILES notation for N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
The canonical SMILES for N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide is Br.C(=Cc1ccc(-c2cn3cc(C=CC=NNC4=NCCN4)ccc3n2)cc1)C=NNC1=NCCN1.
What is the InChIKey of N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
The InChIKey is FEUVWDUYZKJBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N10.BrH/c1(11-30-33-24-26-13-14-27-24)3-19-5-8-21(9-6-19)22-18-35-17-20(7-10-23(35)32-22)4-2-12-31-34-25-28-15-16-29-25;/h1-12,17-18H,13-16H2,(H2,26,27,33)(H2,28,29,34);1H.
What are the key properties of N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide?
N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide has a molecular weight of 547.47 g/mol, XLogP of 2.67, 7 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[4-[6-[3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylideneamino]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide is sourced from PubChem (CID 5469560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).