N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide

C13H17N3O3 — CID 70940989

IUPACN-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide
SMILESO=C(NC(=O)C1CCCN1)C(O)Cc1cccnc1
InChIInChI=1S/C13H17N3O3/c17-11(7-9-3-1-5-14-8-9)13(19)16-12(18)10-4-2-6-15-10/h1,3,5,8,10-11,15,17H,2,4,6-7H2,(H,16,18,19)
InChIKeyIQFNHKJNVHXHSR-UHFFFAOYSA-N
MW263.30 g/mol
LogP-0.62
Rot. Bonds4

About N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide

N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide (PubChem CID 70940989) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide
PubChem CID70940989
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC NameN-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide
SMILESO=C(NC(=O)C1CCCN1)C(O)Cc1cccnc1
InChIInChI=1S/C13H17N3O3/c17-11(7-9-3-1-5-14-8-9)13(19)16-12(18)10-4-2-6-15-10/h1,3,5,8,10-11,15,17H,2,4,6-7H2,(H,16,18,19)
InChIKeyIQFNHKJNVHXHSR-UHFFFAOYSA-N
XLogP-0.62
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 5-0.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-pyridin-3-ylpyrrolidine-2-carboxamide
CID 10607737
(2S)-N-methyl-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide
CID 61155587
N-propan-2-yl-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide
CID 54873750
(2S)-N-[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carboxamide
CID 91975220
N-[3-oxo-3-(pyridin-3-ylamino)propyl]pyrrolidine-2-carboxamide
CID 119873237
N-(pyridin-3-ylmethyl)pyrrolidin-2-amine
CID 90939130
N-[3-chloro-4-(pyridin-3-ylmethoxy)phenyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119847003
5-oxo-N-[1-oxo-3-phenyl-1-(pyrrolidine-2-carbonylamino)propan-2-yl]pyrrolidine-2-carboxamide
CID 69292399
N-[3-oxo-3-(pyridin-3-ylamino)propyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119873236
(2R)-N-[2-(dimethylamino)ethyl]-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide
CID 104901002
(2R)-N-(1-pyridin-3-ylethyl)piperidine-2-carboxamide;hydrochloride
CID 119998811
N-methyl-N-(pyridin-3-ylmethyl)piperidine-2-carboxamide;dihydrochloride
CID 119958234

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide (CID 70940989) is N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide is O=C(NC(=O)C1CCCN1)C(O)Cc1cccnc1.
What is the InChIKey of N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide?
The InChIKey is IQFNHKJNVHXHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3/c17-11(7-9-3-1-5-14-8-9)13(19)16-12(18)10-4-2-6-15-10/h1,3,5,8,10-11,15,17H,2,4,6-7H2,(H,16,18,19).
What are the key properties of N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide?
N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide has a molecular weight of 263.30 g/mol, XLogP of -0.62, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-pyridin-3-ylpropanoyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 70940989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).