3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one

C15H18N4O — CID 118251455

IUPAC3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one
SMILESO=c1[nH]cc(-c2ccncc2)cc1N[C@@H]1CCCNC1
InChIInChI=1S/C15H18N4O/c20-15-14(19-13-2-1-5-17-10-13)8-12(9-18-15)11-3-6-16-7-4-11/h3-4,6-9,13,17,19H,1-2,5,10H2,(H,18,20)/t13-/m1/s1
InChIKeyWZGFRCAAYPMHHG-CYBMUJFWSA-N
MW270.34 g/mol
LogP1.60
Rot. Bonds3

About 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one

3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one (PubChem CID 118251455) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one
PubChem CID118251455
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one
SMILESO=c1[nH]cc(-c2ccncc2)cc1N[C@@H]1CCCNC1
InChIInChI=1S/C15H18N4O/c20-15-14(19-13-2-1-5-17-10-13)8-12(9-18-15)11-3-6-16-7-4-11/h3-4,6-9,13,17,19H,1-2,5,10H2,(H,18,20)/t13-/m1/s1
InChIKeyWZGFRCAAYPMHHG-CYBMUJFWSA-N
XLogP1.60
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one?
The IUPAC name of 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one (CID 118251455) is 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one.
What is the SMILES notation for 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one?
The canonical SMILES for 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one is O=c1[nH]cc(-c2ccncc2)cc1N[C@@H]1CCCNC1.
What is the InChIKey of 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one?
The InChIKey is WZGFRCAAYPMHHG-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H18N4O/c20-15-14(19-13-2-1-5-17-10-13)8-12(9-18-15)11-3-6-16-7-4-11/h3-4,6-9,13,17,19H,1-2,5,10H2,(H,18,20)/t13-/m1/s1.
What are the key properties of 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one?
3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one has a molecular weight of 270.34 g/mol, XLogP of 1.60, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3R)-piperidin-3-yl]amino]-5-pyridin-4-yl-1H-pyridin-2-one is sourced from PubChem (CID 118251455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).