N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine

C20H17ClN4O — CID 46342299

IUPACN-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine
SMILESCOc1cccc(-c2nc3ncccn3c2NCc2ccc(Cl)cc2)c1
InChIInChI=1S/C20H17ClN4O/c1-26-17-5-2-4-15(12-17)18-19(25-11-3-10-22-20(25)24-18)23-13-14-6-8-16(21)9-7-14/h2-12,23H,13H2,1H3
InChIKeySZCDAOGZKYNAKK-UHFFFAOYSA-N
MW364.84 g/mol
LogP4.67
Rot. Bonds5

About N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine

N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine (PubChem CID 46342299) has the molecular formula C20H17ClN4O and a molecular weight of 364.84 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine
PubChem CID46342299
Molecular FormulaC20H17ClN4O
Molecular Weight364.84 g/mol
Exact Mass364.11
IUPAC NameN-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine
SMILESCOc1cccc(-c2nc3ncccn3c2NCc2ccc(Cl)cc2)c1
InChIInChI=1S/C20H17ClN4O/c1-26-17-5-2-4-15(12-17)18-19(25-11-3-10-22-20(25)24-18)23-13-14-6-8-16(21)9-7-14/h2-12,23H,13H2,1H3
InChIKeySZCDAOGZKYNAKK-UHFFFAOYSA-N
XLogP4.67
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.84
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-chlorophenyl)-N-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrimidin-3-amine
CID 20952820
N-benzyl-2-(3-phenylmethoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 20952842
N-[(4-methylphenyl)methyl]-2-phenylimidazo[1,2-a]pyrimidin-3-amine
CID 20952793
N-benzyl-2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 42740240
4-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)imidazo[1,2-a]pyrimidin-2-yl]-2-methoxyphenol
CID 58402606
N-[(2-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 20952833
[3-[3-(benzylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 2-(4-chlorophenoxy)acetate
CID 42743439
4-(3-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]pyrimidin-2-amine
CID 71655715
N-(4-chlorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 7338215
2-(4-methoxyphenoxy)-N-[3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl]acetamide
CID 122285802
N-[(4-methoxyphenyl)methyl]-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)pyrimidin-2-amine
CID 91439875
N-benzyl-5-(4-chlorophenyl)-7-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 132515794

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine (CID 46342299) is N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine is COc1cccc(-c2nc3ncccn3c2NCc2ccc(Cl)cc2)c1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine?
The InChIKey is SZCDAOGZKYNAKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4O/c1-26-17-5-2-4-15(12-17)18-19(25-11-3-10-22-20(25)24-18)23-13-14-6-8-16(21)9-7-14/h2-12,23H,13H2,1H3.
What are the key properties of N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine?
N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine has a molecular weight of 364.84 g/mol, XLogP of 4.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine is sourced from PubChem (CID 46342299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).