phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate

C18H18N2O3 — CID 27639376

IUPACphenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate
SMILESCCN1C(=O)CCc2cc(NC(=O)Oc3ccccc3)ccc21
InChIInChI=1S/C18H18N2O3/c1-2-20-16-10-9-14(12-13(16)8-11-17(20)21)19-18(22)23-15-6-4-3-5-7-15/h3-7,9-10,12H,2,8,11H2,1H3,(H,19,22)
InChIKeyRVRVZCPZRKQQKP-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.60
Rot. Bonds3

About phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate

phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate (PubChem CID 27639376) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate.

Molecular Properties

Compound Namephenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate
PubChem CID27639376
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Namephenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate
SMILESCCN1C(=O)CCc2cc(NC(=O)Oc3ccccc3)ccc21
InChIInChI=1S/C18H18N2O3/c1-2-20-16-10-9-14(12-13(16)8-11-17(20)21)19-18(22)23-15-6-4-3-5-7-15/h3-7,9-10,12H,2,8,11H2,1H3,(H,19,22)
InChIKeyRVRVZCPZRKQQKP-UHFFFAOYSA-N
XLogP3.60
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

phenyl N-[1-(3-methylbutyl)-2-oxo-3,4-dihydroquinolin-6-yl]carbamate
CID 16927201
N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-phenylpropanamide
CID 20933537
N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-2-(4-phenylphenyl)acetamide
CID 40946959
N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-2-methylpropanamide
CID 20933542
N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-2-naphthalen-2-yloxyacetamide
CID 40946919
1-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-(3-methylphenyl)urea
CID 30376245
N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-2-(2-methoxyphenoxy)acetamide
CID 16826791
3-[(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamoylamino]propanoic acid
CID 122089851
1-(3,4-dimethoxyphenyl)-3-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)urea
CID 30376300
N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-2-(3-hydroxyphenyl)acetamide
CID 86791329
2-[(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)amino]ethene-1,1,2-tricarbonitrile
CID 168608537
N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)-2-phenoxybenzamide
CID 16926746

Frequently Asked Questions

What is the IUPAC name of phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate?
The IUPAC name of phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate (CID 27639376) is phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate.
What is the SMILES notation for phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate?
The canonical SMILES for phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate is CCN1C(=O)CCc2cc(NC(=O)Oc3ccccc3)ccc21.
What is the InChIKey of phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate?
The InChIKey is RVRVZCPZRKQQKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-2-20-16-10-9-14(12-13(16)8-11-17(20)21)19-18(22)23-15-6-4-3-5-7-15/h3-7,9-10,12H,2,8,11H2,1H3,(H,19,22).
What are the key properties of phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate?
phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate has a molecular weight of 310.35 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamate is sourced from PubChem (CID 27639376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).