N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide

C18H17N5O — CID 92565345

IUPACN-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide
SMILESCc1ncc(-c2ccccn2)c(CCNC(=O)c2ccncc2)n1
InChIInChI=1S/C18H17N5O/c1-13-22-12-15(16-4-2-3-8-20-16)17(23-13)7-11-21-18(24)14-5-9-19-10-6-14/h2-6,8-10,12H,7,11H2,1H3,(H,21,24)
InChIKeyRWLBPKQMIZMFAR-UHFFFAOYSA-N
MW319.37 g/mol
LogP2.21
Rot. Bonds5

About N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide

N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide (PubChem CID 92565345) has the molecular formula C18H17N5O and a molecular weight of 319.37 g/mol. Its IUPAC name is N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide
PubChem CID92565345
Molecular FormulaC18H17N5O
Molecular Weight319.37 g/mol
Exact Mass319.14
IUPAC NameN-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide
SMILESCc1ncc(-c2ccccn2)c(CCNC(=O)c2ccncc2)n1
InChIInChI=1S/C18H17N5O/c1-13-22-12-15(16-4-2-3-8-20-16)17(23-13)7-11-21-18(24)14-5-9-19-10-6-14/h2-6,8-10,12H,7,11H2,1H3,(H,21,24)
InChIKeyRWLBPKQMIZMFAR-UHFFFAOYSA-N
XLogP2.21
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.37
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]-1,2-oxazole-5-carboxamide
CID 46967270
trans-(1S,2S)-2-methyl-N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]cyclopropane-1-carboxamide
CID 92565325
N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]-2-(3-oxo-1H-isoindol-2-yl)acetamide
CID 92565334
N-[2-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)ethyl]-4-(trifluoromethyl)benzamide
CID 110395472
N-[2-[[2-(4-methylphenoxy)acetyl]amino]ethyl]pyridine-4-carboxamide
CID 2985213
N-[2-[6-(dimethylamino)-2-pyridin-2-ylpyrimidin-4-yl]ethyl]pyridine-3-carboxamide
CID 46974112
4-amino-2-pyridin-2-yl-N-(2-pyridin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide
CID 159200675
N-[2-(4-ethylphenyl)ethyl]pyridine-4-carboxamide
CID 110787242
N-[2-(2,5-dimethylphenyl)ethyl]pyridine-4-carboxamide
CID 110787308
N-[2-(4-methoxyphenoxy)ethyl]pyridine-4-carboxamide
CID 27173434
4-methyl-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]benzamide
CID 90588265
N-[2-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]pyridine-4-carboxamide
CID 110321211

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide?
The IUPAC name of N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide (CID 92565345) is N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide is Cc1ncc(-c2ccccn2)c(CCNC(=O)c2ccncc2)n1.
What is the InChIKey of N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide?
The InChIKey is RWLBPKQMIZMFAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O/c1-13-22-12-15(16-4-2-3-8-20-16)17(23-13)7-11-21-18(24)14-5-9-19-10-6-14/h2-6,8-10,12H,7,11H2,1H3,(H,21,24).
What are the key properties of N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide?
N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide has a molecular weight of 319.37 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 92565345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).