3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide

C14H21N3O — CID 62209973

IUPAC3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide
SMILESO=C(CCC1CCCCN1)NCc1cccnc1
InChIInChI=1S/C14H21N3O/c18-14(7-6-13-5-1-2-9-16-13)17-11-12-4-3-8-15-10-12/h3-4,8,10,13,16H,1-2,5-7,9,11H2,(H,17,18)
InChIKeyBRQKPNYGCJKECS-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.62
Rot. Bonds5

About 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide

3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 62209973) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide
PubChem CID62209973
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide
SMILESO=C(CCC1CCCCN1)NCc1cccnc1
InChIInChI=1S/C14H21N3O/c18-14(7-6-13-5-1-2-9-16-13)17-11-12-4-3-8-15-10-12/h3-4,8,10,13,16H,1-2,5-7,9,11H2,(H,17,18)
InChIKeyBRQKPNYGCJKECS-UHFFFAOYSA-N
XLogP1.62
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-hydroxyphenyl)methyl]-3-piperidin-2-ylpropanamide
CID 114332165
N-[(6-methoxy-3-pyridinyl)methyl]-3-piperidin-2-ylpropanamide
CID 62209908
2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide
CID 115160524
1-[(2R)-piperidin-2-yl]-N-(pyridin-3-ylmethyl)methanamine
CID 97178382
3-(cyclopentylamino)-N-(pyridin-3-ylmethyl)propanamide
CID 109013619
3-piperazin-1-yl-N-(pyridin-3-ylmethyl)propanamide
CID 28807813
N-[[(2R)-piperidin-2-yl]methyl]-1-pyridin-3-ylmethanesulfonamide
CID 97165898
N-(pyridin-3-ylmethyl)cyclopentanecarboxamide
CID 595870
N-[(2,5-difluorophenyl)methyl]-3-piperidin-2-ylpropanamide
CID 63794479
2-piperidin-3-yl-N-(pyridin-3-ylmethyl)acetamide
CID 62675411
N-[2-(3-methylphenyl)ethyl]-3-piperidin-2-ylpropanamide
CID 62315398
3-cyclopentyl-N-[3-(pyridin-3-ylmethylamino)propyl]propanamide
CID 43600543

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide (CID 62209973) is 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide is O=C(CCC1CCCCN1)NCc1cccnc1.
What is the InChIKey of 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is BRQKPNYGCJKECS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c18-14(7-6-13-5-1-2-9-16-13)17-11-12-4-3-8-15-10-12/h3-4,8,10,13,16H,1-2,5-7,9,11H2,(H,17,18).
What are the key properties of 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide?
3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide has a molecular weight of 247.34 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-2-yl-N-(pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 62209973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).