(3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide

C15H16N4O2 — CID 97084803

IUPAC(3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccn1)N1CC[C@H](Oc2cccnc2)C1
InChIInChI=1S/C15H16N4O2/c20-15(18-14-5-1-2-8-17-14)19-9-6-13(11-19)21-12-4-3-7-16-10-12/h1-5,7-8,10,13H,6,9,11H2,(H,17,18,20)/t13-/m0/s1
InChIKeyLRXNYYMGUKSSKI-ZDUSSCGKSA-N
MW284.32 g/mol
LogP2.16
Rot. Bonds3

About (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide

(3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide (PubChem CID 97084803) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide
PubChem CID97084803
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name(3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccn1)N1CC[C@H](Oc2cccnc2)C1
InChIInChI=1S/C15H16N4O2/c20-15(18-14-5-1-2-8-17-14)19-9-6-13(11-19)21-12-4-3-7-16-10-12/h1-5,7-8,10,13H,6,9,11H2,(H,17,18,20)/t13-/m0/s1
InChIKeyLRXNYYMGUKSSKI-ZDUSSCGKSA-N
XLogP2.16
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-propan-2-yloxy-2-pyridinyl)-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 119043695
1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone
CID 59581393
(3R)-3-[[2-(dimethylamino)-3-pyridinyl]oxy]-N-pyridin-2-ylpyrrolidine-1-carboxamide
CID 129477549
2-oxo-2-(3-pyridin-3-yloxypyrrolidin-1-yl)acetamide
CID 175996540
pyridin-4-yl-(3-pyridin-3-yloxypyrrolidin-1-yl)methanone
CID 110876433
(3S)-N-(2,3-dihydro-1H-inden-5-yl)-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 97078501
(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 97078503
N-pyridin-2-yl-3-(pyridin-2-ylamino)pyrrolidine-1-carboxamide
CID 166407641
(3R)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 97064402
(3S)-3-pyridin-3-yloxy-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyrrolidine-1-carboxamide
CID 97012552
(3S)-N-(1-methyl-2,3-dihydroindol-4-yl)-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 97227478
(2R)-2-amino-1-[(3R)-3-pyridin-3-yloxypyrrolidin-1-yl]propan-1-one
CID 124593054

Frequently Asked Questions

What is the IUPAC name of (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide?
The IUPAC name of (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide (CID 97084803) is (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide.
What is the SMILES notation for (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide?
The canonical SMILES for (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide is O=C(Nc1ccccn1)N1CC[C@H](Oc2cccnc2)C1.
What is the InChIKey of (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide?
The InChIKey is LRXNYYMGUKSSKI-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H16N4O2/c20-15(18-14-5-1-2-8-17-14)19-9-6-13(11-19)21-12-4-3-7-16-10-12/h1-5,7-8,10,13H,6,9,11H2,(H,17,18,20)/t13-/m0/s1.
What are the key properties of (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide?
(3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide is sourced from PubChem (CID 97084803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).