N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide

C21H26N4O2 — CID 15005606

IUPACN-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide
SMILESO=C(CCCCc1ccc2nc3[nH]c(=O)[nH]c3cc2c1)NC1CCCCC1
InChIInChI=1S/C21H26N4O2/c26-19(22-16-7-2-1-3-8-16)9-5-4-6-14-10-11-17-15(12-14)13-18-20(23-17)25-21(27)24-18/h10-13,16H,1-9H2,(H,22,26)(H2,23,24,25,27)
InChIKeyCJSUCKSZFYSKBS-UHFFFAOYSA-N
MW366.47 g/mol
LogP3.57
Rot. Bonds6

About N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide

N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide (PubChem CID 15005606) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide.

Molecular Properties

Compound NameN-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide
PubChem CID15005606
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC NameN-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide
SMILESO=C(CCCCc1ccc2nc3[nH]c(=O)[nH]c3cc2c1)NC1CCCCC1
InChIInChI=1S/C21H26N4O2/c26-19(22-16-7-2-1-3-8-16)9-5-4-6-14-10-11-17-15(12-14)13-18-20(23-17)25-21(27)24-18/h10-13,16H,1-9H2,(H,22,26)(H2,23,24,25,27)
InChIKeyCJSUCKSZFYSKBS-UHFFFAOYSA-N
XLogP3.57
TPSA90.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 53.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide?
The IUPAC name of N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide (CID 15005606) is N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide.
What is the SMILES notation for N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide?
The canonical SMILES for N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide is O=C(CCCCc1ccc2nc3[nH]c(=O)[nH]c3cc2c1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide?
The InChIKey is CJSUCKSZFYSKBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c26-19(22-16-7-2-1-3-8-16)9-5-4-6-14-10-11-17-15(12-14)13-18-20(23-17)25-21(27)24-18/h10-13,16H,1-9H2,(H,22,26)(H2,23,24,25,27).
What are the key properties of N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide?
N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide has a molecular weight of 366.47 g/mol, XLogP of 3.57, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)pentanamide is sourced from PubChem (CID 15005606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).