7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile

C23H19N5 — CID 46927162

IUPAC7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile
SMILESN#Cc1cnc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)cn12
InChIInChI=1S/C23H19N5/c24-13-19-14-26-22-27-21(20(15-28(19)22)16-5-2-1-3-6-16)17-7-9-18(10-8-17)23(25)11-4-12-23/h1-3,5-10,14-15H,4,11-12,25H2
InChIKeyWNZMWNAQNAGMFY-UHFFFAOYSA-N
MW365.44 g/mol
LogP4.27
Rot. Bonds3

About 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile

7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile (PubChem CID 46927162) has the molecular formula C23H19N5 and a molecular weight of 365.44 g/mol. Its IUPAC name is 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile.

Molecular Properties

Compound Name7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile
PubChem CID46927162
Molecular FormulaC23H19N5
Molecular Weight365.44 g/mol
Exact Mass365.16
IUPAC Name7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile
SMILESN#Cc1cnc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)cn12
InChIInChI=1S/C23H19N5/c24-13-19-14-26-22-27-21(20(15-28(19)22)16-5-2-1-3-6-16)17-7-9-18(10-8-17)23(25)11-4-12-23/h1-3,5-10,14-15H,4,11-12,25H2
InChIKeyWNZMWNAQNAGMFY-UHFFFAOYSA-N
XLogP4.27
TPSA80.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-[3-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrimidin-7-yl]phenyl]cyclobutan-1-amine
CID 56602592
1-[4-(2,6-diphenylimidazo[1,2-a]pyrimidin-7-yl)phenyl]cyclobutan-1-amine
CID 46927245
1-[4-(6-phenyl-2-pyrazin-2-yl-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)phenyl]cyclobutan-1-amine
CID 46927620
1-[4-(2-phenoxy-6-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)phenyl]cyclobutan-1-amine
CID 46927471
1-[4-(2-ethyl-6-phenylimidazo[1,2-a]pyrimidin-7-yl)phenyl]cyclobutan-1-amine
CID 46927249
1-[4-[2-(3-methoxypropyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclobutan-1-amine
CID 147220702
5-[4-(1-aminocyclobutyl)phenyl]-N-(2-methoxyethyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
CID 56602593
N-[5-[4-(1-aminocyclobutyl)phenyl]-6-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]cyclopropanecarboxamide
CID 46927544
1-[4-(7-bromo-3-phenylpyrimido[1,2-b]indazol-2-yl)phenyl]cyclobutan-1-amine
CID 57378515
6-[4-(1-aminocyclobutyl)phenyl]-2-(aminomethyl)-5-phenylpyridin-3-amine
CID 174663749
1-[4-[10-(4-methylphenyl)-3-phenylpyrimido[1,2-b]indazol-2-yl]phenyl]cyclobutan-1-amine
CID 57378412
2-[4-(1-aminocyclobutyl)phenyl]-3-phenyl-8H-pyrano[3,4-b]pyridin-5-one
CID 53261732

Frequently Asked Questions

What is the IUPAC name of 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile?
The IUPAC name of 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile (CID 46927162) is 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile.
What is the SMILES notation for 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile?
The canonical SMILES for 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile is N#Cc1cnc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)cn12.
What is the InChIKey of 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile?
The InChIKey is WNZMWNAQNAGMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N5/c24-13-19-14-26-22-27-21(20(15-28(19)22)16-5-2-1-3-6-16)17-7-9-18(10-8-17)23(25)11-4-12-23/h1-3,5-10,14-15H,4,11-12,25H2.
What are the key properties of 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile?
7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile has a molecular weight of 365.44 g/mol, XLogP of 4.27, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-(1-aminocyclobutyl)phenyl]-6-phenylimidazo[1,2-a]pyrimidine-3-carbonitrile is sourced from PubChem (CID 46927162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).