6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid

C13H14N4O3 — CID 177169705

IUPAC6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid
SMILESO=C(O)c1cnc(N2CC[C@@H](O)C2)c(-c2ccn[nH]2)c1
InChIInChI=1S/C13H14N4O3/c18-9-2-4-17(7-9)12-10(11-1-3-15-16-11)5-8(6-14-12)13(19)20/h1,3,5-6,9,18H,2,4,7H2,(H,15,16)(H,19,20)/t9-/m1/s1
InChIKeyRRAMXNZMWYFPCP-SECBINFHSA-N
MW274.28 g/mol
LogP0.74
Rot. Bonds3

About 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid

6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid (PubChem CID 177169705) has the molecular formula C13H14N4O3 and a molecular weight of 274.28 g/mol. Its IUPAC name is 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid
PubChem CID177169705
Molecular FormulaC13H14N4O3
Molecular Weight274.28 g/mol
Exact Mass274.11
IUPAC Name6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid
SMILESO=C(O)c1cnc(N2CC[C@@H](O)C2)c(-c2ccn[nH]2)c1
InChIInChI=1S/C13H14N4O3/c18-9-2-4-17(7-9)12-10(11-1-3-15-16-11)5-8(6-14-12)13(19)20/h1,3,5-6,9,18H,2,4,7H2,(H,15,16)(H,19,20)/t9-/m1/s1
InChIKeyRRAMXNZMWYFPCP-SECBINFHSA-N
XLogP0.74
TPSA102.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;hydrochloride
CID 133082086
N-[4-[chloro(difluoro)methoxy]phenyl]-6-(3-fluoropyrrolidin-1-yl)-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide
CID 123812201
2-(cyclopropanecarbonylamino)-6-(3-hydroxypyrrolidin-1-yl)-5-(1H-pyrazol-5-yl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 175533365
6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-imidazol-2-yl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 118045551
N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine
CID 123958418
N-[4-[chloro(difluoro)methoxy]phenyl]-5-(1H-pyrazol-5-yl)-6-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyridine-3-carboxamide
CID 118044927
5-(5-bromo-1H-pyrrol-2-yl)-N-[4-(1-chloro-1-fluorobut-3-enoxy)phenyl]-6-[(3R)-3-hydroxypyrrolidin-1-yl]pyridine-3-carboxamide
CID 163992190
6-(1,3-oxazolidin-3-yl)-N-[4-(1,1,2,2,2-pentafluoroethyl)phenyl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide
CID 134267733
2-(4-hydroxypiperidin-1-yl)pyrimidine-5-carboxylic acid
CID 53415565
N-[4-[chloro(difluoro)methoxy]phenyl]-6-(3-hydroxypyrrolidin-1-yl)-5-(4-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 118195396
6-[(3R)-3-[2-[2-[2-[2-[[(1R,2S,4S,5S,6R)-5,6-dihydroxybicyclo[2.2.1]heptane-2-carbonyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]pyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 118233398
N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(2H-tetrazol-5-yl)pyridine-3-carboxamide
CID 135258202

Frequently Asked Questions

What is the IUPAC name of 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid?
The IUPAC name of 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid (CID 177169705) is 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid?
The canonical SMILES for 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid is O=C(O)c1cnc(N2CC[C@@H](O)C2)c(-c2ccn[nH]2)c1.
What is the InChIKey of 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid?
The InChIKey is RRAMXNZMWYFPCP-SECBINFHSA-N. The full InChI is InChI=1S/C13H14N4O3/c18-9-2-4-17(7-9)12-10(11-1-3-15-16-11)5-8(6-14-12)13(19)20/h1,3,5-6,9,18H,2,4,7H2,(H,15,16)(H,19,20)/t9-/m1/s1.
What are the key properties of 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid?
6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid has a molecular weight of 274.28 g/mol, XLogP of 0.74, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid is sourced from PubChem (CID 177169705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).