N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine

C22H16N4 — CID 132524899

IUPACN-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine
SMILESc1ccc(N(c2ccc3nc4ccccn4c3c2)c2ccccn2)cc1
InChIInChI=1S/C22H16N4/c1-2-8-17(9-3-1)26(21-10-4-6-14-23-21)18-12-13-19-20(16-18)25-15-7-5-11-22(25)24-19/h1-16H
InChIKeyUYCFHUUTWHJNSM-UHFFFAOYSA-N
MW336.40 g/mol
LogP5.35
Rot. Bonds3

About N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine

N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine (PubChem CID 132524899) has the molecular formula C22H16N4 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine.

Molecular Properties

Compound NameN-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine
PubChem CID132524899
Molecular FormulaC22H16N4
Molecular Weight336.40 g/mol
Exact Mass336.14
IUPAC NameN-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine
SMILESc1ccc(N(c2ccc3nc4ccccn4c3c2)c2ccccn2)cc1
InChIInChI=1S/C22H16N4/c1-2-8-17(9-3-1)26(21-10-4-6-14-23-21)18-12-13-19-20(16-18)25-15-7-5-11-22(25)24-19/h1-16H
InChIKeyUYCFHUUTWHJNSM-UHFFFAOYSA-N
XLogP5.35
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.40
LogP ≤ 55.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-N,2-N,7-N,7-N-tetrapyridin-2-ylnaphthalene-2,7-diamine
CID 102277389
N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine
CID 23135801
N-phenyl-6-pyridin-2-yl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine
CID 58704261
ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine
CID 144605066
6-[diphenyl-[3-(N-pyridin-2-ylanilino)phenyl]silyl]-N,N-diphenylpyridin-2-amine
CID 140743228
9,21-dimethyl-6-N,18-N-dipyridin-2-yl-6-N,18-N-dipyridin-4-yl-9,21-diazahexacyclo[11.11.0.02,10.03,8.014,22.015,20]tetracosa-1(13),2(10),3(8),4,6,11,14(22),15(20),16,18,23-undecaene-6,18-diamine
CID 59181864
N-phenyl-N-[4-[4-(2-triphenylsilylethenyl)phenyl]phenyl]pyridin-2-amine
CID 123423561
4-(N-pyridin-2-ylanilino)benzamide
CID 123830429
N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-N-phenylpyridin-2-amine
CID 58121682
N-[4-[(E)-1,2-diphenyl-2-(15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaen-3-yl)ethenyl]phenyl]-N-pyridin-2-ylpyridin-2-amine
CID 90363907
6-methyl-N-[3-(2-phenylimidazo[1,2-a]pyridin-3-yl)phenyl]-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]pyridin-2-amine
CID 167376713
N-[4-[[4-(dipyridin-2-ylamino)phenyl]-dimethylsilyl]phenyl]-N-pyridin-2-ylpyridin-2-amine
CID 101222424

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine?
The IUPAC name of N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine (CID 132524899) is N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine.
What is the SMILES notation for N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine?
The canonical SMILES for N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine is c1ccc(N(c2ccc3nc4ccccn4c3c2)c2ccccn2)cc1.
What is the InChIKey of N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine?
The InChIKey is UYCFHUUTWHJNSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4/c1-2-8-17(9-3-1)26(21-10-4-6-14-23-21)18-12-13-19-20(16-18)25-15-7-5-11-22(25)24-19/h1-16H.
What are the key properties of N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine?
N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine has a molecular weight of 336.40 g/mol, XLogP of 5.35, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-pyridin-2-ylpyrido[1,2-a]benzimidazol-8-amine is sourced from PubChem (CID 132524899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).