7-chloro-N,N-diethylquinoline-2-carboxamide

C14H15ClN2O — CID 110490272

IUPAC7-chloro-N,N-diethylquinoline-2-carboxamide
SMILESCCN(CC)C(=O)c1ccc2ccc(Cl)cc2n1
InChIInChI=1S/C14H15ClN2O/c1-3-17(4-2)14(18)12-8-6-10-5-7-11(15)9-13(10)16-12/h5-9H,3-4H2,1-2H3
InChIKeyHPWZFASKVBFPIO-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.37
Rot. Bonds3

About 7-chloro-N,N-diethylquinoline-2-carboxamide

7-chloro-N,N-diethylquinoline-2-carboxamide (PubChem CID 110490272) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is 7-chloro-N,N-diethylquinoline-2-carboxamide.

Molecular Properties

Compound Name7-chloro-N,N-diethylquinoline-2-carboxamide
PubChem CID110490272
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name7-chloro-N,N-diethylquinoline-2-carboxamide
SMILESCCN(CC)C(=O)c1ccc2ccc(Cl)cc2n1
InChIInChI=1S/C14H15ClN2O/c1-3-17(4-2)14(18)12-8-6-10-5-7-11(15)9-13(10)16-12/h5-9H,3-4H2,1-2H3
InChIKeyHPWZFASKVBFPIO-UHFFFAOYSA-N
XLogP3.37
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-N,N-diethylquinoline-2-carboxamide?
The IUPAC name of 7-chloro-N,N-diethylquinoline-2-carboxamide (CID 110490272) is 7-chloro-N,N-diethylquinoline-2-carboxamide.
What is the SMILES notation for 7-chloro-N,N-diethylquinoline-2-carboxamide?
The canonical SMILES for 7-chloro-N,N-diethylquinoline-2-carboxamide is CCN(CC)C(=O)c1ccc2ccc(Cl)cc2n1.
What is the InChIKey of 7-chloro-N,N-diethylquinoline-2-carboxamide?
The InChIKey is HPWZFASKVBFPIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-3-17(4-2)14(18)12-8-6-10-5-7-11(15)9-13(10)16-12/h5-9H,3-4H2,1-2H3.
What are the key properties of 7-chloro-N,N-diethylquinoline-2-carboxamide?
7-chloro-N,N-diethylquinoline-2-carboxamide has a molecular weight of 262.74 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N,N-diethylquinoline-2-carboxamide is sourced from PubChem (CID 110490272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).