N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine

C22H23N5 — CID 77095018

IUPACN-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine
SMILESCC(Cc1ccccn1)N(C)Cc1c(-c2ccccc2)nc2ncccn12
InChIInChI=1S/C22H23N5/c1-17(15-19-11-6-7-12-23-19)26(2)16-20-21(18-9-4-3-5-10-18)25-22-24-13-8-14-27(20)22/h3-14,17H,15-16H2,1-2H3
InChIKeyKWATTZABBPTWHH-UHFFFAOYSA-N
MW357.46 g/mol
LogP3.85
Rot. Bonds6

About N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine

N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine (PubChem CID 77095018) has the molecular formula C22H23N5 and a molecular weight of 357.46 g/mol. Its IUPAC name is N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine
PubChem CID77095018
Molecular FormulaC22H23N5
Molecular Weight357.46 g/mol
Exact Mass357.20
IUPAC NameN-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine
SMILESCC(Cc1ccccn1)N(C)Cc1c(-c2ccccc2)nc2ncccn12
InChIInChI=1S/C22H23N5/c1-17(15-19-11-6-7-12-23-19)26(2)16-20-21(18-9-4-3-5-10-18)25-22-24-13-8-14-27(20)22/h3-14,17H,15-16H2,1-2H3
InChIKeyKWATTZABBPTWHH-UHFFFAOYSA-N
XLogP3.85
TPSA46.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-phenylimidazo[1,2-a]pyrimidin-3-yl)ethanamine
CID 82292189
4-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]morpholine
CID 122183034
2-phenyl-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyrimidine
CID 122183039
2-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine
CID 122183047
N-methyl-N-[(4-methylsulfonylphenyl)methyl]-1-pyridin-2-ylpropan-2-amine
CID 50980184
(2R)-N-[(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine
CID 95119763
(2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine
CID 51871878
3-phenyl-2-(4-propylsulfanylphenyl)imidazo[1,2-a]pyrimidine
CID 69378756
3-N-methyl-3-N-(pyridin-2-ylmethyl)butane-1,3-diamine
CID 60914164
2-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 82299531
2-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-3,4-dihydro-1H-isoquinolin-4-ol
CID 70726889
5-(hydroxymethyl)-2-methyl-4-[[methyl(1-pyridin-2-ylpropan-2-yl)amino]methyl]pyridin-3-ol
CID 56721630

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine?
The IUPAC name of N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine (CID 77095018) is N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine.
What is the SMILES notation for N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine?
The canonical SMILES for N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine is CC(Cc1ccccn1)N(C)Cc1c(-c2ccccc2)nc2ncccn12.
What is the InChIKey of N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine?
The InChIKey is KWATTZABBPTWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5/c1-17(15-19-11-6-7-12-23-19)26(2)16-20-21(18-9-4-3-5-10-18)25-22-24-13-8-14-27(20)22/h3-14,17H,15-16H2,1-2H3.
What are the key properties of N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine?
N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine has a molecular weight of 357.46 g/mol, XLogP of 3.85, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]-1-pyridin-2-ylpropan-2-amine is sourced from PubChem (CID 77095018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).