N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide

C15H23N3O — CID 3041531

IUPACN-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide
SMILESCCC(=O)N(c1ccccn1)C(C)CN1CCCC1
InChIInChI=1S/C15H23N3O/c1-3-15(19)18(14-8-4-5-9-16-14)13(2)12-17-10-6-7-11-17/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3
InChIKeyCMDFJUAFTUKYSH-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.31
Rot. Bonds5

About N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide

N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide (PubChem CID 3041531) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide.

Molecular Properties

Compound NameN-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide
PubChem CID3041531
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide
SMILESCCC(=O)N(c1ccccn1)C(C)CN1CCCC1
InChIInChI=1S/C15H23N3O/c1-3-15(19)18(14-8-4-5-9-16-14)13(2)12-17-10-6-7-11-17/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3
InChIKeyCMDFJUAFTUKYSH-UHFFFAOYSA-N
XLogP2.31
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide?
The IUPAC name of N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide (CID 3041531) is N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide.
What is the SMILES notation for N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide?
The canonical SMILES for N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide is CCC(=O)N(c1ccccn1)C(C)CN1CCCC1.
What is the InChIKey of N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide?
The InChIKey is CMDFJUAFTUKYSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-15(19)18(14-8-4-5-9-16-14)13(2)12-17-10-6-7-11-17/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3.
What are the key properties of N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide?
N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide has a molecular weight of 261.37 g/mol, XLogP of 2.31, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)propanamide is sourced from PubChem (CID 3041531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).