(2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide

C14H13BrN2O2 — CID 35287150

IUPAC(2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(Br)c2cccnc12)[C@H]1CCCO1
InChIInChI=1S/C14H13BrN2O2/c15-10-5-6-11(13-9(10)3-1-7-16-13)17-14(18)12-4-2-8-19-12/h1,3,5-7,12H,2,4,8H2,(H,17,18)/t12-/m1/s1
InChIKeyLEIPJBSAUYIXCT-GFCCVEGCSA-N
MW321.17 g/mol
LogP3.11
Rot. Bonds2

About (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide

(2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide (PubChem CID 35287150) has the molecular formula C14H13BrN2O2 and a molecular weight of 321.17 g/mol. Its IUPAC name is (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide
PubChem CID35287150
Molecular FormulaC14H13BrN2O2
Molecular Weight321.17 g/mol
Exact Mass320.02
IUPAC Name(2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(Br)c2cccnc12)[C@H]1CCCO1
InChIInChI=1S/C14H13BrN2O2/c15-10-5-6-11(13-9(10)3-1-7-16-13)17-14(18)12-4-2-8-19-12/h1,3,5-7,12H,2,4,8H2,(H,17,18)/t12-/m1/s1
InChIKeyLEIPJBSAUYIXCT-GFCCVEGCSA-N
XLogP3.11
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.17
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-quinolin-8-yloxane-2-carboxamide
CID 110863491
N-(2-bromo-3-pyridinyl)oxane-2-carboxamide
CID 103822374
N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide
CID 4166852
N-(5-bromoquinolin-8-yl)-2-(oxolan-3-yl)acetamide
CID 119051811
N-(6-methoxyquinolin-8-yl)oxolane-2-carboxamide
CID 110715523
2-[(5-bromoquinolin-8-yl)amino]-2-oxoacetic acid
CID 22742503
N-(2-bromophenyl)oxane-2-carboxamide
CID 62214619
N-(1-methylisoquinolin-5-yl)oxolane-2-carboxamide
CID 154789089
N-(5-bromoquinolin-8-yl)-1-methylsulfonylpiperidine-3-carboxamide
CID 17023445
N-(2-bromo-5-chlorophenyl)oxolane-2-carboxamide
CID 81272173
3-bromo-4-[[(2R)-oxolane-2-carbonyl]amino]benzoic acid
CID 104855724
N-(5-bromoquinolin-8-yl)butanamide
CID 35287139

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide?
The IUPAC name of (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide (CID 35287150) is (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide is O=C(Nc1ccc(Br)c2cccnc12)[C@H]1CCCO1.
What is the InChIKey of (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide?
The InChIKey is LEIPJBSAUYIXCT-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H13BrN2O2/c15-10-5-6-11(13-9(10)3-1-7-16-13)17-14(18)12-4-2-8-19-12/h1,3,5-7,12H,2,4,8H2,(H,17,18)/t12-/m1/s1.
What are the key properties of (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide?
(2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide has a molecular weight of 321.17 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide is sourced from PubChem (CID 35287150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).