N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine

C19H22N4O — CID 42740276

IUPACN-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine
SMILESCOc1ccccc1/C=C/c1nc2ncccn2c1NC(C)(C)C
InChIInChI=1S/C19H22N4O/c1-19(2,3)22-17-15(21-18-20-12-7-13-23(17)18)11-10-14-8-5-6-9-16(14)24-4/h5-13,22H,1-4H3/b11-10+
InChIKeySDHQSBUIEOLVFA-ZHACJKMWSA-N
MW322.41 g/mol
LogP4.12
Rot. Bonds4

About N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine

N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine (PubChem CID 42740276) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine.

Molecular Properties

Compound NameN-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine
PubChem CID42740276
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC NameN-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine
SMILESCOc1ccccc1/C=C/c1nc2ncccn2c1NC(C)(C)C
InChIInChI=1S/C19H22N4O/c1-19(2,3)22-17-15(21-18-20-12-7-13-23(17)18)11-10-14-8-5-6-9-16(14)24-4/h5-13,22H,1-4H3/b11-10+
InChIKeySDHQSBUIEOLVFA-ZHACJKMWSA-N
XLogP4.12
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine with MolForge

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Related Compounds

ethyl 2-[[2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-yl]amino]acetate
CID 42740215
2-[(E)-2-(2-methoxyphenyl)ethenyl]pyridine
CID 127035001
2-[2-(2-methoxyphenyl)ethenyl]-3,5,6-trimethylpyrazine
CID 141144702
1-[(E)-3,3-dimethylbut-1-enyl]-2-methoxybenzene
CID 10375267
N-cyclohexyl-2-[2-(2-methoxyphenyl)ethenyl]-7-methylimidazo[1,2-a]pyridin-3-amine
CID 5104575
N-[(2-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 20952833
(E)-3-(2-methoxyphenyl)-N-(2-pyrazol-1-ylethyl)prop-2-en-1-amine
CID 56823424
N-benzyl-2-[2-(2-methoxyphenyl)ethenyl]-5-methylimidazo[1,2-a]pyridin-3-amine
CID 4271216
2-[(E)-1-phenylprop-1-en-2-yl]-N-(2,4,4-trimethylpentan-2-yl)imidazo[1,2-a]pyrimidin-3-amine
CID 42741257
1-(2-fluoroethenyl)-2-methoxybenzene
CID 134862998
N-cyclohexyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]-5-methylimidazo[1,2-a]pyridin-3-amine
CID 6055909
N-benzyl-2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 42740240

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine?
The IUPAC name of N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine (CID 42740276) is N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine.
What is the SMILES notation for N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine?
The canonical SMILES for N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine is COc1ccccc1/C=C/c1nc2ncccn2c1NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine?
The InChIKey is SDHQSBUIEOLVFA-ZHACJKMWSA-N. The full InChI is InChI=1S/C19H22N4O/c1-19(2,3)22-17-15(21-18-20-12-7-13-23(17)18)11-10-14-8-5-6-9-16(14)24-4/h5-13,22H,1-4H3/b11-10+.
What are the key properties of N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine?
N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine has a molecular weight of 322.41 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(E)-2-(2-methoxyphenyl)ethenyl]imidazo[1,2-a]pyrimidin-3-amine is sourced from PubChem (CID 42740276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).