6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide

C24H38N4O — CID 59818775

IUPAC6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide
SMILESCCCC(C)NC(=O)c1ccc(N2CCC3(CC2)CCN(C2CCC2)CC3)nc1
InChIInChI=1S/C24H38N4O/c1-3-5-19(2)26-23(29)20-8-9-22(25-18-20)28-16-12-24(13-17-28)10-14-27(15-11-24)21-6-4-7-21/h8-9,18-19,21H,3-7,10-17H2,1-2H3,(H,26,29)
InChIKeyXVDVUDRQPQAHNV-UHFFFAOYSA-N
MW398.60 g/mol
LogP4.23
Rot. Bonds6

About 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide

6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide (PubChem CID 59818775) has the molecular formula C24H38N4O and a molecular weight of 398.60 g/mol. Its IUPAC name is 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide
PubChem CID59818775
Molecular FormulaC24H38N4O
Molecular Weight398.60 g/mol
Exact Mass398.30
IUPAC Name6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide
SMILESCCCC(C)NC(=O)c1ccc(N2CCC3(CC2)CCN(C2CCC2)CC3)nc1
InChIInChI=1S/C24H38N4O/c1-3-5-19(2)26-23(29)20-8-9-22(25-18-20)28-16-12-24(13-17-28)10-14-27(15-11-24)21-6-4-7-21/h8-9,18-19,21H,3-7,10-17H2,1-2H3,(H,26,29)
InChIKeyXVDVUDRQPQAHNV-UHFFFAOYSA-N
XLogP4.23
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.60
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide with MolForge

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Related Compounds

N-pentan-2-yl-6-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]pyridine-3-carboxamide
CID 68739288
N-propan-2-yl-6-(4-propylpiperazin-1-yl)pyridine-3-carboxamide
CID 168923141
N-pentan-2-yl-6-[4-(thiophene-2-carbonyl)piperazin-1-yl]pyridine-3-carboxamide
CID 68737088
6-[4-[2-[4-[(1S)-cyclobut-2-en-1-yl]piperazin-1-yl]-2-oxoethyl]piperazin-1-yl]-N-pentan-2-ylpyridine-3-carboxamide
CID 143404324
6-[4-(1-methylpiperidin-3-yl)piperazin-1-yl]-N-propylpyridine-3-carboxamide
CID 133315644
N-(6-methylheptan-2-yl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 46515997
6-[4-(2-naphthalen-2-ylacetyl)piperazin-1-yl]-N-pentan-2-ylpyridine-3-carboxamide
CID 68738298
N-[(2S)-butan-2-yl]-4-(6-piperidin-1-yl-3-pyridinyl)benzamide
CID 95097436
N-propan-2-yl-6-(4-propan-2-ylpiperazin-1-yl)pyridine-3-carboxamide
CID 901299
N-[(2R)-5-(diethylamino)pentan-2-yl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 94813287
methyl 6-[4-(4-ethylcyclohexyl)piperazin-1-yl]pyridine-3-carboxylate
CID 22492996
6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide
CID 47080109

Frequently Asked Questions

What is the IUPAC name of 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide?
The IUPAC name of 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide (CID 59818775) is 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide is CCCC(C)NC(=O)c1ccc(N2CCC3(CC2)CCN(C2CCC2)CC3)nc1.
What is the InChIKey of 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide?
The InChIKey is XVDVUDRQPQAHNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38N4O/c1-3-5-19(2)26-23(29)20-8-9-22(25-18-20)28-16-12-24(13-17-28)10-14-27(15-11-24)21-6-4-7-21/h8-9,18-19,21H,3-7,10-17H2,1-2H3,(H,26,29).
What are the key properties of 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide?
6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide has a molecular weight of 398.60 g/mol, XLogP of 4.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(9-cyclobutyl-3,9-diazaspiro[5.5]undecan-3-yl)-N-pentan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 59818775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).