4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide

C24H23N3O2 — CID 109091644

IUPAC4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide
SMILESCCN(C(=O)c1cc(C(=O)N2CCCc3ccccc32)ccn1)c1ccccc1
InChIInChI=1S/C24H23N3O2/c1-2-26(20-11-4-3-5-12-20)24(29)21-17-19(14-15-25-21)23(28)27-16-8-10-18-9-6-7-13-22(18)27/h3-7,9,11-15,17H,2,8,10,16H2,1H3
InChIKeyLGTBJWIYHSNDFT-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.34
Rot. Bonds4

About 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide

4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide (PubChem CID 109091644) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide
PubChem CID109091644
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC Name4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide
SMILESCCN(C(=O)c1cc(C(=O)N2CCCc3ccccc32)ccn1)c1ccccc1
InChIInChI=1S/C24H23N3O2/c1-2-26(20-11-4-3-5-12-20)24(29)21-17-19(14-15-25-21)23(28)27-16-8-10-18-9-6-7-13-22(18)27/h3-7,9,11-15,17H,2,8,10,16H2,1H3
InChIKeyLGTBJWIYHSNDFT-UHFFFAOYSA-N
XLogP4.34
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide?
The IUPAC name of 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide (CID 109091644) is 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide?
The canonical SMILES for 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide is CCN(C(=O)c1cc(C(=O)N2CCCc3ccccc32)ccn1)c1ccccc1.
What is the InChIKey of 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide?
The InChIKey is LGTBJWIYHSNDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-2-26(20-11-4-3-5-12-20)24(29)21-17-19(14-15-25-21)23(28)27-16-8-10-18-9-6-7-13-22(18)27/h3-7,9,11-15,17H,2,8,10,16H2,1H3.
What are the key properties of 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide?
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide has a molecular weight of 385.47 g/mol, XLogP of 4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 109091644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).