quinolin-8-yl N-(3-methoxyphenyl)carbamate

C17H14N2O3 — CID 4116749

IUPACquinolin-8-yl N-(3-methoxyphenyl)carbamate
SMILESCOc1cccc(NC(=O)Oc2cccc3cccnc23)c1
InChIInChI=1S/C17H14N2O3/c1-21-14-8-3-7-13(11-14)19-17(20)22-15-9-2-5-12-6-4-10-18-16(12)15/h2-11H,1H3,(H,19,20)
InChIKeyDPXMLSDSCUXHRR-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.85
Rot. Bonds3

About quinolin-8-yl N-(3-methoxyphenyl)carbamate

quinolin-8-yl N-(3-methoxyphenyl)carbamate (PubChem CID 4116749) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is quinolin-8-yl N-(3-methoxyphenyl)carbamate.

Molecular Properties

Compound Namequinolin-8-yl N-(3-methoxyphenyl)carbamate
PubChem CID4116749
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC Namequinolin-8-yl N-(3-methoxyphenyl)carbamate
SMILESCOc1cccc(NC(=O)Oc2cccc3cccnc23)c1
InChIInChI=1S/C17H14N2O3/c1-21-14-8-3-7-13(11-14)19-17(20)22-15-9-2-5-12-6-4-10-18-16(12)15/h2-11H,1H3,(H,19,20)
InChIKeyDPXMLSDSCUXHRR-UHFFFAOYSA-N
XLogP3.85
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of quinolin-8-yl N-(3-methoxyphenyl)carbamate?
The IUPAC name of quinolin-8-yl N-(3-methoxyphenyl)carbamate (CID 4116749) is quinolin-8-yl N-(3-methoxyphenyl)carbamate.
What is the SMILES notation for quinolin-8-yl N-(3-methoxyphenyl)carbamate?
The canonical SMILES for quinolin-8-yl N-(3-methoxyphenyl)carbamate is COc1cccc(NC(=O)Oc2cccc3cccnc23)c1.
What is the InChIKey of quinolin-8-yl N-(3-methoxyphenyl)carbamate?
The InChIKey is DPXMLSDSCUXHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-21-14-8-3-7-13(11-14)19-17(20)22-15-9-2-5-12-6-4-10-18-16(12)15/h2-11H,1H3,(H,19,20).
What are the key properties of quinolin-8-yl N-(3-methoxyphenyl)carbamate?
quinolin-8-yl N-(3-methoxyphenyl)carbamate has a molecular weight of 294.31 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for quinolin-8-yl N-(3-methoxyphenyl)carbamate is sourced from PubChem (CID 4116749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).