1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone

C23H25N7O2 — CID 138689287

IUPAC1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone
SMILESCOc1cccc2c1nc(N)n1cc(Cc3ccnc(N4CCN(C(C)=O)CC4)c3)nc21
InChIInChI=1S/C23H25N7O2/c1-15(31)28-8-10-29(11-9-28)20-13-16(6-7-25-20)12-17-14-30-22(26-17)18-4-3-5-19(32-2)21(18)27-23(30)24/h3-7,13-14H,8-12H2,1-2H3,(H2,24,27)
InChIKeyQNWWTYAHOFXRNF-UHFFFAOYSA-N
MW431.50 g/mol
LogP2.13
Rot. Bonds4

About 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone

1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone (PubChem CID 138689287) has the molecular formula C23H25N7O2 and a molecular weight of 431.50 g/mol. Its IUPAC name is 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone
PubChem CID138689287
Molecular FormulaC23H25N7O2
Molecular Weight431.50 g/mol
Exact Mass431.21
IUPAC Name1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone
SMILESCOc1cccc2c1nc(N)n1cc(Cc3ccnc(N4CCN(C(C)=O)CC4)c3)nc21
InChIInChI=1S/C23H25N7O2/c1-15(31)28-8-10-29(11-9-28)20-13-16(6-7-25-20)12-17-14-30-22(26-17)18-4-3-5-19(32-2)21(18)27-23(30)24/h3-7,13-14H,8-12H2,1-2H3,(H2,24,27)
InChIKeyQNWWTYAHOFXRNF-UHFFFAOYSA-N
XLogP2.13
TPSA101.88 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.50
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone with MolForge

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Launch Full Analysis

Related Compounds

2-[[4-[3-[(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl]-4-phenylphenyl]-3-morpholin-4-ylphenyl]methyl]-7-methoxyimidazo[1,2-c]quinazolin-5-amine
CID 138721114
(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(2,2-dimethylmorpholin-4-yl)methanone
CID 138689559
[4-[(5-amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl]piperidin-1-yl]-(4-methoxy-2-pyridinyl)methanone
CID 138689604
7-methoxy-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 90268021
(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(1,4-oxazepan-4-yl)methanone
CID 138689663
2-benzyl-7-(trifluoromethoxy)imidazo[1,2-c]quinazolin-5-amine
CID 138689468
(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(2R,6R)-2,6-dimethylmorpholin-4-yl]methanone
CID 138689599
(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone
CID 138689694
3-bromo-1-[4-(8-methoxy-4-methylquinolin-2-yl)piperazin-1-yl]propan-1-one
CID 108741927
(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone
CID 138689546
4-(2,6-dimethylphenoxy)-1-[4-(8-methoxy-4-methylquinolin-2-yl)piperazin-1-yl]butan-1-one
CID 108764444
8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline
CID 23931520

Frequently Asked Questions

What is the IUPAC name of 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone?
The IUPAC name of 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone (CID 138689287) is 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone?
The canonical SMILES for 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone is COc1cccc2c1nc(N)n1cc(Cc3ccnc(N4CCN(C(C)=O)CC4)c3)nc21.
What is the InChIKey of 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone?
The InChIKey is QNWWTYAHOFXRNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N7O2/c1-15(31)28-8-10-29(11-9-28)20-13-16(6-7-25-20)12-17-14-30-22(26-17)18-4-3-5-19(32-2)21(18)27-23(30)24/h3-7,13-14H,8-12H2,1-2H3,(H2,24,27).
What are the key properties of 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone?
1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone has a molecular weight of 431.50 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[4-[(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)methyl]-2-pyridinyl]piperazin-1-yl]ethanone is sourced from PubChem (CID 138689287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).