(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone

C19H21N5O2 — CID 138689694

IUPAC(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone
SMILESCOc1cccc2c1nc(N)n1cc(C(=O)N3CCCC4(CC4)C3)nc21
InChIInChI=1S/C19H21N5O2/c1-26-14-5-2-4-12-15(14)22-18(20)24-10-13(21-16(12)24)17(25)23-9-3-6-19(11-23)7-8-19/h2,4-5,10H,3,6-9,11H2,1H3,(H2,20,22)
InChIKeyHDNTYCCYBCKGNM-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.49
Rot. Bonds2

About (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone

(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone (PubChem CID 138689694) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone.

Molecular Properties

Compound Name(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone
PubChem CID138689694
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone
SMILESCOc1cccc2c1nc(N)n1cc(C(=O)N3CCCC4(CC4)C3)nc21
InChIInChI=1S/C19H21N5O2/c1-26-14-5-2-4-12-15(14)22-18(20)24-10-13(21-16(12)24)17(25)23-9-3-6-19(11-23)7-8-19/h2,4-5,10H,3,6-9,11H2,1H3,(H2,20,22)
InChIKeyHDNTYCCYBCKGNM-UHFFFAOYSA-N
XLogP2.49
TPSA85.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone?
The IUPAC name of (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone (CID 138689694) is (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone.
What is the SMILES notation for (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone?
The canonical SMILES for (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone is COc1cccc2c1nc(N)n1cc(C(=O)N3CCCC4(CC4)C3)nc21.
What is the InChIKey of (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone?
The InChIKey is HDNTYCCYBCKGNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-26-14-5-2-4-12-15(14)22-18(20)24-10-13(21-16(12)24)17(25)23-9-3-6-19(11-23)7-8-19/h2,4-5,10H,3,6-9,11H2,1H3,(H2,20,22).
What are the key properties of (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone?
(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone has a molecular weight of 351.41 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-(5-azaspiro[2.5]octan-5-yl)methanone is sourced from PubChem (CID 138689694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).