N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide

C16H17N3O2 — CID 646148

IUPACN-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(NC(=O)Cc2ccccc2)cn1
InChIInChI=1S/C16H17N3O2/c1-2-15(20)19-14-9-8-13(11-17-14)18-16(21)10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,18,21)(H,17,19,20)
InChIKeyNHOIYJYMKIWEPK-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.61
Rot. Bonds5

About N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide

N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide (PubChem CID 646148) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide
PubChem CID646148
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC NameN-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(NC(=O)Cc2ccccc2)cn1
InChIInChI=1S/C16H17N3O2/c1-2-15(20)19-14-9-8-13(11-17-14)18-16(21)10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,18,21)(H,17,19,20)
InChIKeyNHOIYJYMKIWEPK-UHFFFAOYSA-N
XLogP2.61
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide?
The IUPAC name of N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide (CID 646148) is N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide.
What is the SMILES notation for N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide?
The canonical SMILES for N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide is CCC(=O)Nc1ccc(NC(=O)Cc2ccccc2)cn1.
What is the InChIKey of N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide?
The InChIKey is NHOIYJYMKIWEPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-2-15(20)19-14-9-8-13(11-17-14)18-16(21)10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,18,21)(H,17,19,20).
What are the key properties of N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide?
N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide has a molecular weight of 283.33 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-phenylacetyl)amino]-2-pyridinyl]propanamide is sourced from PubChem (CID 646148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).