4-(methylamino)-N-quinolin-5-ylbenzamide

C17H15N3O — CID 62187273

IUPAC4-(methylamino)-N-quinolin-5-ylbenzamide
SMILESCNc1ccc(C(=O)Nc2cccc3ncccc23)cc1
InChIInChI=1S/C17H15N3O/c1-18-13-9-7-12(8-10-13)17(21)20-16-6-2-5-15-14(16)4-3-11-19-15/h2-11,18H,1H3,(H,20,21)
InChIKeyCCLIOLMHYBABHR-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.53
Rot. Bonds3

About 4-(methylamino)-N-quinolin-5-ylbenzamide

4-(methylamino)-N-quinolin-5-ylbenzamide (PubChem CID 62187273) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 4-(methylamino)-N-quinolin-5-ylbenzamide.

Molecular Properties

Compound Name4-(methylamino)-N-quinolin-5-ylbenzamide
PubChem CID62187273
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name4-(methylamino)-N-quinolin-5-ylbenzamide
SMILESCNc1ccc(C(=O)Nc2cccc3ncccc23)cc1
InChIInChI=1S/C17H15N3O/c1-18-13-9-7-12(8-10-13)17(21)20-16-6-2-5-15-14(16)4-3-11-19-15/h2-11,18H,1H3,(H,20,21)
InChIKeyCCLIOLMHYBABHR-UHFFFAOYSA-N
XLogP3.53
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(diethylamino)-N-quinolin-5-ylbenzamide
CID 112767915
4-methylsulfinyl-N-quinolin-5-ylbenzamide
CID 51182481
4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide
CID 79043682
4-(bromomethyl)-N-quinolin-5-ylbenzamide
CID 102850797
2,3-dimethyl-N-quinolin-5-ylquinoxaline-6-carboxamide
CID 51205597
4-butoxy-N-quinolin-5-ylbenzamide
CID 3982301
2,6-dichloro-N-quinolin-5-ylpyridine-4-carboxamide
CID 2782162
3-chloro-N-quinolin-5-ylbenzamide
CID 5127132
N-quinolin-5-ylpyridine-2-carboxamide
CID 3985423
6-(methylamino)-N-quinolin-5-ylpyridazine-3-carboxamide
CID 62187272
2-bromo-N-quinolin-5-ylpyridine-4-carboxamide
CID 103751909
CID 73213052
CID 73213052

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-quinolin-5-ylbenzamide?
The IUPAC name of 4-(methylamino)-N-quinolin-5-ylbenzamide (CID 62187273) is 4-(methylamino)-N-quinolin-5-ylbenzamide.
What is the SMILES notation for 4-(methylamino)-N-quinolin-5-ylbenzamide?
The canonical SMILES for 4-(methylamino)-N-quinolin-5-ylbenzamide is CNc1ccc(C(=O)Nc2cccc3ncccc23)cc1.
What is the InChIKey of 4-(methylamino)-N-quinolin-5-ylbenzamide?
The InChIKey is CCLIOLMHYBABHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-18-13-9-7-12(8-10-13)17(21)20-16-6-2-5-15-14(16)4-3-11-19-15/h2-11,18H,1H3,(H,20,21).
What are the key properties of 4-(methylamino)-N-quinolin-5-ylbenzamide?
4-(methylamino)-N-quinolin-5-ylbenzamide has a molecular weight of 277.33 g/mol, XLogP of 3.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-quinolin-5-ylbenzamide is sourced from PubChem (CID 62187273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).