3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide

C14H22N4O — CID 173012594

IUPAC3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide
SMILESCN(c1cc(CCC(N)=O)ccn1)C1CCNCC1
InChIInChI=1S/C14H22N4O/c1-18(12-5-7-16-8-6-12)14-10-11(4-9-17-14)2-3-13(15)19/h4,9-10,12,16H,2-3,5-8H2,1H3,(H2,15,19)
InChIKeyCXUOGGAWMYNAPI-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.69
Rot. Bonds5

About 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide

3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide (PubChem CID 173012594) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide.

Molecular Properties

Compound Name3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide
PubChem CID173012594
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide
SMILESCN(c1cc(CCC(N)=O)ccn1)C1CCNCC1
InChIInChI=1S/C14H22N4O/c1-18(12-5-7-16-8-6-12)14-10-11(4-9-17-14)2-3-13(15)19/h4,9-10,12,16H,2-3,5-8H2,1H3,(H2,15,19)
InChIKeyCXUOGGAWMYNAPI-UHFFFAOYSA-N
XLogP0.69
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide?
The IUPAC name of 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide (CID 173012594) is 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide.
What is the SMILES notation for 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide?
The canonical SMILES for 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide is CN(c1cc(CCC(N)=O)ccn1)C1CCNCC1.
What is the InChIKey of 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide?
The InChIKey is CXUOGGAWMYNAPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-18(12-5-7-16-8-6-12)14-10-11(4-9-17-14)2-3-13(15)19/h4,9-10,12,16H,2-3,5-8H2,1H3,(H2,15,19).
What are the key properties of 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide?
3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide has a molecular weight of 262.36 g/mol, XLogP of 0.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[methyl(piperidin-4-yl)amino]-4-pyridinyl]propanamide is sourced from PubChem (CID 173012594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).