N-[6-(benzylamino)-3-pyridinyl]propanamide

C15H17N3O — CID 110178661

IUPACN-[6-(benzylamino)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(NCc2ccccc2)nc1
InChIInChI=1S/C15H17N3O/c1-2-15(19)18-13-8-9-14(17-11-13)16-10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,16,17)(H,18,19)
InChIKeyDNGBXENOCCFIGI-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.04
Rot. Bonds5

About N-[6-(benzylamino)-3-pyridinyl]propanamide

N-[6-(benzylamino)-3-pyridinyl]propanamide (PubChem CID 110178661) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[6-(benzylamino)-3-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[6-(benzylamino)-3-pyridinyl]propanamide
PubChem CID110178661
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-[6-(benzylamino)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(NCc2ccccc2)nc1
InChIInChI=1S/C15H17N3O/c1-2-15(19)18-13-8-9-14(17-11-13)16-10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,16,17)(H,18,19)
InChIKeyDNGBXENOCCFIGI-UHFFFAOYSA-N
XLogP3.04
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]-2-phenylacetamide
CID 113012292
N-[5-[(4-fluorophenyl)methylamino]-2-pyridinyl]propanamide
CID 113027073
N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]butanamide
CID 113011745
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]butanamide
CID 113012264
N-[5-(benzylamino)-2-pyridinyl]-2,2-dimethylpropanamide
CID 113026364
1-phenyl-3-[6-(pyridin-4-ylmethylamino)-3-pyridinyl]urea
CID 113012942
N-[6-(2-hydroxypropylamino)-3-pyridinyl]-2-phenylacetamide
CID 82022490
N-[6-(benzylamino)-3-pyridinyl]-3,5-dimethoxybenzamide
CID 113011445
N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
CID 113026477
3-phenoxy-N-[6-(pyridin-4-ylmethylamino)-3-pyridinyl]propanamide
CID 113012923
N-[5-(benzylamino)-2-pyridinyl]benzamide
CID 113026368
2,2-dimethyl-N-[6-(propanoylamino)-3-pyridinyl]propanamide
CID 1452729

Frequently Asked Questions

What is the IUPAC name of N-[6-(benzylamino)-3-pyridinyl]propanamide?
The IUPAC name of N-[6-(benzylamino)-3-pyridinyl]propanamide (CID 110178661) is N-[6-(benzylamino)-3-pyridinyl]propanamide.
What is the SMILES notation for N-[6-(benzylamino)-3-pyridinyl]propanamide?
The canonical SMILES for N-[6-(benzylamino)-3-pyridinyl]propanamide is CCC(=O)Nc1ccc(NCc2ccccc2)nc1.
What is the InChIKey of N-[6-(benzylamino)-3-pyridinyl]propanamide?
The InChIKey is DNGBXENOCCFIGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-2-15(19)18-13-8-9-14(17-11-13)16-10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,16,17)(H,18,19).
What are the key properties of N-[6-(benzylamino)-3-pyridinyl]propanamide?
N-[6-(benzylamino)-3-pyridinyl]propanamide has a molecular weight of 255.32 g/mol, XLogP of 3.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(benzylamino)-3-pyridinyl]propanamide is sourced from PubChem (CID 110178661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).