4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide

C21H24N4O2 — CID 70496351

IUPAC4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
SMILESCc1ccnc(C(=O)NC23CCCC(NC(=O)c4ccccn4)(CC2)C3)c1
InChIInChI=1S/C21H24N4O2/c1-15-6-12-23-17(13-15)19(27)25-21-8-4-7-20(14-21,9-10-21)24-18(26)16-5-2-3-11-22-16/h2-3,5-6,11-13H,4,7-10,14H2,1H3,(H,24,26)(H,25,27)
InChIKeyGTLMPOUVZDWSDY-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.79
Rot. Bonds4

About 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide

4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide (PubChem CID 70496351) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
PubChem CID70496351
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
SMILESCc1ccnc(C(=O)NC23CCCC(NC(=O)c4ccccn4)(CC2)C3)c1
InChIInChI=1S/C21H24N4O2/c1-15-6-12-23-17(13-15)19(27)25-21-8-4-7-20(14-21,9-10-21)24-18(26)16-5-2-3-11-22-16/h2-3,5-6,11-13H,4,7-10,14H2,1H3,(H,24,26)(H,25,27)
InChIKeyGTLMPOUVZDWSDY-UHFFFAOYSA-N
XLogP2.79
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide with MolForge

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Related Compounds

N-[5-[(3-chlorobenzoyl)amino]-1-bicyclo[3.2.1]octanyl]-4-methylpyridine-2-carboxamide
CID 57406121
2-methyl-N-[5-[(3-methylbenzoyl)amino]-1-bicyclo[3.2.1]octanyl]pyrimidine-4-carboxamide
CID 57406485
N-(4-propan-2-yl-1-bicyclo[2.2.1]heptanyl)pyridine-2-carboxamide
CID 118410766
4-methyl-N-[5-(5-methyl-2H-pyrazin-1-yl)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
CID 141426147
N-[5-[[2-[(Z)-1-methylsulfanylprop-1-en-2-yl]iminoacetyl]amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
CID 57404601
N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 46307927
N-(1-methylcyclobutyl)pyridine-2-carboxamide
CID 175814951
N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
CID 130286496
N-[5-[[2-(6-methylpyrazine-2-carbonyl)hydrazinyl]methyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
CID 123921285
N-[5-[(3-methylbenzoyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-3-carboxamide
CID 70497716
N-[4-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-1-bicyclo[2.1.1]hexanyl]pyridine-2-carboxamide
CID 158400664
6-methyl-N-[5-(pyrimidine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyrazine-2-carboxamide
CID 57407036

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?
The IUPAC name of 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide (CID 70496351) is 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?
The canonical SMILES for 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide is Cc1ccnc(C(=O)NC23CCCC(NC(=O)c4ccccn4)(CC2)C3)c1.
What is the InChIKey of 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?
The InChIKey is GTLMPOUVZDWSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-15-6-12-23-17(13-15)19(27)25-21-8-4-7-20(14-21,9-10-21)24-18(26)16-5-2-3-11-22-16/h2-3,5-6,11-13H,4,7-10,14H2,1H3,(H,24,26)(H,25,27).
What are the key properties of 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?
4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[5-(pyridine-2-carbonylamino)-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide is sourced from PubChem (CID 70496351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).