N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide

C20H26N4O3 — CID 135515478

IUPACN-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide
SMILESO=C1CN2Cc3cc(OCCCC(=O)NC4CCCCC4)ccc3N=C2N1
InChIInChI=1S/C20H26N4O3/c25-18(21-15-5-2-1-3-6-15)7-4-10-27-16-8-9-17-14(11-16)12-24-13-19(26)23-20(24)22-17/h8-9,11,15H,1-7,10,12-13H2,(H,21,25)(H,22,23,26)
InChIKeyLZPXGUMZFMVDBG-UHFFFAOYSA-N
MW370.45 g/mol
LogP2.23
Rot. Bonds6

About N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide

N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide (PubChem CID 135515478) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide
PubChem CID135515478
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC NameN-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide
SMILESO=C1CN2Cc3cc(OCCCC(=O)NC4CCCCC4)ccc3N=C2N1
InChIInChI=1S/C20H26N4O3/c25-18(21-15-5-2-1-3-6-15)7-4-10-27-16-8-9-17-14(11-16)12-24-13-19(26)23-20(24)22-17/h8-9,11,15H,1-7,10,12-13H2,(H,21,25)(H,22,23,26)
InChIKeyLZPXGUMZFMVDBG-UHFFFAOYSA-N
XLogP2.23
TPSA83.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide?
The IUPAC name of N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide (CID 135515478) is N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide.
What is the SMILES notation for N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide?
The canonical SMILES for N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide is O=C1CN2Cc3cc(OCCCC(=O)NC4CCCCC4)ccc3N=C2N1.
What is the InChIKey of N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide?
The InChIKey is LZPXGUMZFMVDBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O3/c25-18(21-15-5-2-1-3-6-15)7-4-10-27-16-8-9-17-14(11-16)12-24-13-19(26)23-20(24)22-17/h8-9,11,15H,1-7,10,12-13H2,(H,21,25)(H,22,23,26).
What are the key properties of N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide?
N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide has a molecular weight of 370.45 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide is sourced from PubChem (CID 135515478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).