(2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid

C15H21N3O3 — CID 138028631

IUPAC(2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid
SMILESO=C(O)[C@H]1CCCCN1C(=O)Cc1cnn2c1CCCC2
InChIInChI=1S/C15H21N3O3/c19-14(17-7-3-1-6-13(17)15(20)21)9-11-10-16-18-8-4-2-5-12(11)18/h10,13H,1-9H2,(H,20,21)/t13-/m1/s1
InChIKeyGKMNLCFRTBIPHK-CYBMUJFWSA-N
MW291.35 g/mol
LogP1.23
Rot. Bonds3

About (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid

(2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid (PubChem CID 138028631) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid
PubChem CID138028631
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name(2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid
SMILESO=C(O)[C@H]1CCCCN1C(=O)Cc1cnn2c1CCCC2
InChIInChI=1S/C15H21N3O3/c19-14(17-7-3-1-6-13(17)15(20)21)9-11-10-16-18-8-4-2-5-12(11)18/h10,13H,1-9H2,(H,20,21)/t13-/m1/s1
InChIKeyGKMNLCFRTBIPHK-CYBMUJFWSA-N
XLogP1.23
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid with MolForge

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Related Compounds

1-[2-(4-hydroxyphenyl)acetyl]azepane-2-carboxylic acid
CID 64558978
1-(2-naphthalen-1-ylacetyl)piperidine-2-carboxylic acid
CID 43822910
(1R)-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-ylmethyl)cyclohex-3-ene-1-carboxamide
CID 129354971
1-(2-pyrrolidin-1-ylacetyl)piperidine-2-carboxylic acid
CID 68753456
1-[2-(2,6-dichlorophenyl)acetyl]piperidine-2-carboxylic acid
CID 43239840
1-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]pyrrolidine-2-carboxylic acid
CID 43239484
1-[2-(2,5-difluorophenyl)acetyl]piperidine-2-carboxylic acid
CID 119176055
(2S)-1-[2-(6-methyl-3-pyridinyl)acetyl]pyrrolidine-2-carboxylic acid
CID 119364937
(2R)-1-[2-(2-methoxyphenyl)acetyl]piperidine-2-carboxylic acid
CID 79034352
1-[2-(2,4-dichlorophenyl)acetyl]azepane-2-carboxylic acid
CID 64558807
(2R)-1-(2-aminoacetyl)piperidine-2-carboxylic acid
CID 79034620
1-[2-(4-fluorophenyl)acetyl]pyrrolidine-2-carboxylic acid
CID 16796004

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid?
The IUPAC name of (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid (CID 138028631) is (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid.
What is the SMILES notation for (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid?
The canonical SMILES for (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid is O=C(O)[C@H]1CCCCN1C(=O)Cc1cnn2c1CCCC2.
What is the InChIKey of (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid?
The InChIKey is GKMNLCFRTBIPHK-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21N3O3/c19-14(17-7-3-1-6-13(17)15(20)21)9-11-10-16-18-8-4-2-5-12(11)18/h10,13H,1-9H2,(H,20,21)/t13-/m1/s1.
What are the key properties of (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid?
(2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid has a molecular weight of 291.35 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetyl]piperidine-2-carboxylic acid is sourced from PubChem (CID 138028631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).