6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid

C19H25N3O3 — CID 72854969

IUPAC6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCC3(CCCN(C4CCCC4)C3=O)C2)n1
InChIInChI=1S/C19H25N3O3/c23-17(24)15-7-3-8-16(20-15)21-12-10-19(13-21)9-4-11-22(18(19)25)14-5-1-2-6-14/h3,7-8,14H,1-2,4-6,9-13H2,(H,23,24)
InChIKeyBENWRPHUDFAKRT-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.54
Rot. Bonds3

About 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid

6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid (PubChem CID 72854969) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid
PubChem CID72854969
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCC3(CCCN(C4CCCC4)C3=O)C2)n1
InChIInChI=1S/C19H25N3O3/c23-17(24)15-7-3-8-16(20-15)21-12-10-19(13-21)9-4-11-22(18(19)25)14-5-1-2-6-14/h3,7-8,14H,1-2,4-6,9-13H2,(H,23,24)
InChIKeyBENWRPHUDFAKRT-UHFFFAOYSA-N
XLogP2.54
TPSA73.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)-N-methylpyridine-2-carboxamide
CID 72885425
6-[(5S)-7-(cyclobutylmethyl)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]pyridine-2-carboxylic acid
CID 97122101
7-cyclopentyl-2-pyridazin-3-yl-2,7-diazaspiro[4.5]decan-6-one
CID 86283608
(5S)-7-cyclohexyl-2-(2-methylsulfanylpyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-6-one
CID 97131419
(5R)-7-cyclopentyl-2-(5-fluoro-2-pyridinyl)-2,7-diazaspiro[4.5]decan-6-one
CID 97147036
6-(4,4-dimethylazepan-1-yl)pyridine-2-carboxylic acid
CID 65283066
2-[4-[(5R)-9-(6-fluoro-2-pyridinyl)-1-oxo-2,9-diazaspiro[4.5]decan-2-yl]cyclohexyl]acetonitrile
CID 118370054
N-methyl-6-[(5R)-6-oxo-7-propyl-2,7-diazaspiro[4.5]decan-2-yl]pyridine-2-carboxamide
CID 97202736
2-[(5S)-7-cyclohexyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]pyridine-4-carbonitrile
CID 97155948
2-cyclohexyl-9-(5-methyl-2-pyridinyl)-2,9-diazaspiro[4.5]decan-1-one
CID 143229463
8-(6-fluoro-2-pyridinyl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one
CID 16739588
(5S)-2-(3-chlorobenzoyl)-7-cyclohexyl-2,7-diazaspiro[4.5]decan-6-one
CID 97127071

Frequently Asked Questions

What is the IUPAC name of 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid?
The IUPAC name of 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid (CID 72854969) is 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid is O=C(O)c1cccc(N2CCC3(CCCN(C4CCCC4)C3=O)C2)n1.
What is the InChIKey of 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid?
The InChIKey is BENWRPHUDFAKRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c23-17(24)15-7-3-8-16(20-15)21-12-10-19(13-21)9-4-11-22(18(19)25)14-5-1-2-6-14/h3,7-8,14H,1-2,4-6,9-13H2,(H,23,24).
What are the key properties of 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid?
6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid has a molecular weight of 343.43 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7-cyclopentyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 72854969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).