N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide

C17H16N4O — CID 110705070

IUPACN-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide
SMILESCN(CCc1ccncc1)C(=O)c1cc2ccccc2nn1
InChIInChI=1S/C17H16N4O/c1-21(11-8-13-6-9-18-10-7-13)17(22)16-12-14-4-2-3-5-15(14)19-20-16/h2-7,9-10,12H,8,11H2,1H3
InChIKeyKZXHECPVXAVELF-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.34
Rot. Bonds4

About N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide

N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide (PubChem CID 110705070) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide
PubChem CID110705070
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC NameN-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide
SMILESCN(CCc1ccncc1)C(=O)c1cc2ccccc2nn1
InChIInChI=1S/C17H16N4O/c1-21(11-8-13-6-9-18-10-7-13)17(22)16-12-14-4-2-3-5-15(14)19-20-16/h2-7,9-10,12H,8,11H2,1H3
InChIKeyKZXHECPVXAVELF-UHFFFAOYSA-N
XLogP2.34
TPSA58.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N-(2-pyridin-4-ylethyl)pyrimidine-4-carboxamide
CID 110699109
N,2-dimethyl-N-(2-pyridin-4-ylethyl)quinazoline-4-carboxamide
CID 110702828
N-methyl-N-phenylcinnoline-3-carboxamide
CID 110705116
3-[methyl(2-pyridin-4-ylethyl)carbamoyl]-1,2-oxazole-5-carboxylic acid
CID 107369258
4-chloro-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-2-carboxamide
CID 61051888
4-(dipropylamino)-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-2-carboxamide
CID 109214653
N-methyl-2-oxo-N-(2-pyridin-4-ylethyl)chromene-3-carboxamide
CID 110440706
N-methyl-6-(propan-2-ylamino)-N-(2-pyridin-4-ylethyl)pyridazine-3-carboxamide
CID 109109444
N-methyl-4-pyridin-4-yl-N-(2-pyridin-4-ylethyl)-1,6-naphthyridine-2-carboxamide
CID 92607536
2-N-(3-chlorophenyl)-6-N-methyl-6-N-(2-pyridin-4-ylethyl)pyridine-2,6-dicarboxamide
CID 109098702
N-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-4-carboxamide
CID 110689492
2-(dipropylamino)-N-methyl-N-(2-pyridin-4-ylethyl)pyrimidine-4-carboxamide
CID 109309038

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide?
The IUPAC name of N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide (CID 110705070) is N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide.
What is the SMILES notation for N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide?
The canonical SMILES for N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide is CN(CCc1ccncc1)C(=O)c1cc2ccccc2nn1.
What is the InChIKey of N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide?
The InChIKey is KZXHECPVXAVELF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c1-21(11-8-13-6-9-18-10-7-13)17(22)16-12-14-4-2-3-5-15(14)19-20-16/h2-7,9-10,12H,8,11H2,1H3.
What are the key properties of N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide?
N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 2.34, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-pyridin-4-ylethyl)cinnoline-3-carboxamide is sourced from PubChem (CID 110705070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).