2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide

C12H17N3O2 — CID 173180177

IUPAC2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide
SMILESCCN(C(=O)Cc1ccccn1)C(C)C(N)=O
InChIInChI=1S/C12H17N3O2/c1-3-15(9(2)12(13)17)11(16)8-10-6-4-5-7-14-10/h4-7,9H,3,8H2,1-2H3,(H2,13,17)
InChIKeyZCJNNPIQKROMFQ-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.35
Rot. Bonds5

About 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide

2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide (PubChem CID 173180177) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide.

Molecular Properties

Compound Name2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide
PubChem CID173180177
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide
SMILESCCN(C(=O)Cc1ccccn1)C(C)C(N)=O
InChIInChI=1S/C12H17N3O2/c1-3-15(9(2)12(13)17)11(16)8-10-6-4-5-7-14-10/h4-7,9H,3,8H2,1-2H3,(H2,13,17)
InChIKeyZCJNNPIQKROMFQ-UHFFFAOYSA-N
XLogP0.35
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[ethyl-(2-pyridin-2-ylacetyl)amino]-2-methylpropanoic acid
CID 55123242
N,N-dipropyl-2-pyridin-2-ylacetamide
CID 110696960
methane;3-methyl-1-pyridin-2-ylbutan-2-one
CID 159764567
N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylacetamide
CID 62681126
ethyl 2-[methyl-(2-pyridin-2-ylacetyl)amino]acetate
CID 55003377
molecular hydrogen;2-pyridin-2-ylacetamide
CID 145224814
4-amino-1-pyridin-2-ylhexan-2-one
CID 116609167
ethyl acetate;2-pyridin-2-ylacetic acid
CID 70044808
3-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)but-2-enamide
CID 51088401
N-propan-2-yl-2-pyrazol-1-yl-N-(pyridin-2-ylmethyl)acetamide
CID 51088398
(3S)-3-hydroxy-3,4-dimethyl-1-pyridin-2-ylpentan-2-one
CID 125490825
3-methyl-2-(pyridin-2-ylmethylamino)butanamide
CID 67707485

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide?
The IUPAC name of 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide (CID 173180177) is 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide.
What is the SMILES notation for 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide?
The canonical SMILES for 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide is CCN(C(=O)Cc1ccccn1)C(C)C(N)=O.
What is the InChIKey of 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide?
The InChIKey is ZCJNNPIQKROMFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-3-15(9(2)12(13)17)11(16)8-10-6-4-5-7-14-10/h4-7,9H,3,8H2,1-2H3,(H2,13,17).
What are the key properties of 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide?
2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide has a molecular weight of 235.29 g/mol, XLogP of 0.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(2-pyridin-2-ylacetyl)amino]propanamide is sourced from PubChem (CID 173180177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).