2-acetamido-N-[2-(ethylamino)ethyl]acetamide

C8H17N3O2 — CID 62657470

IUPAC2-acetamido-N-[2-(ethylamino)ethyl]acetamide
SMILESCCNCCNC(=O)CNC(C)=O
InChIInChI=1S/C8H17N3O2/c1-3-9-4-5-10-8(13)6-11-7(2)12/h9H,3-6H2,1-2H3,(H,10,13)(H,11,12)
InChIKeyYTTDDUCXJGKROW-UHFFFAOYSA-N
MW187.24 g/mol
LogP-1.15
Rot. Bonds6

About 2-acetamido-N-[2-(ethylamino)ethyl]acetamide

2-acetamido-N-[2-(ethylamino)ethyl]acetamide (PubChem CID 62657470) has the molecular formula C8H17N3O2 and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-acetamido-N-[2-(ethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-acetamido-N-[2-(ethylamino)ethyl]acetamide
PubChem CID62657470
Molecular FormulaC8H17N3O2
Molecular Weight187.24 g/mol
Exact Mass187.13
IUPAC Name2-acetamido-N-[2-(ethylamino)ethyl]acetamide
SMILESCCNCCNC(=O)CNC(C)=O
InChIInChI=1S/C8H17N3O2/c1-3-9-4-5-10-8(13)6-11-7(2)12/h9H,3-6H2,1-2H3,(H,10,13)(H,11,12)
InChIKeyYTTDDUCXJGKROW-UHFFFAOYSA-N
XLogP-1.15
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 5-1.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(ethylamino)ethyl]acetamide;propane
CID 159314545
N-[2-[2-[2-[2-(ethylamino)ethylamino]ethylamino]ethylamino]ethyl]acetamide
CID 88534902
N-[2-[2-(ethylamino)ethylamino]-2-oxoethyl]butanamide;hydrochloride
CID 119508003
N-[2-[2-[2-(ethylamino)ethylamino]ethoxy]ethyl]acetamide
CID 155740927
N-[2-(ethylamino)ethyl]-3,3,3-trifluoropropanamide
CID 62657279
2-cyclopropyl-N-[2-(ethylamino)ethyl]acetamide
CID 62659717
N-[2-(ethylamino)ethyl]-3-(2-methoxyethoxy)propanamide
CID 119508820
N-(2-acetamidoethyl)-2-(prop-2-ynylamino)acetamide
CID 112722327
N-[2-(ethylamino)ethyl]-3-methoxypropanamide
CID 62658774
N-[2-(ethylamino)ethyl]dodecanamide
CID 65426365
N-[2-(dimethylcarbamoylamino)ethyl]-3-(ethylamino)propanamide
CID 83111812
2-acetamido-N-(3-trimethoxysilylpropyl)acetamide
CID 87064791

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-[2-(ethylamino)ethyl]acetamide?
The IUPAC name of 2-acetamido-N-[2-(ethylamino)ethyl]acetamide (CID 62657470) is 2-acetamido-N-[2-(ethylamino)ethyl]acetamide.
What is the SMILES notation for 2-acetamido-N-[2-(ethylamino)ethyl]acetamide?
The canonical SMILES for 2-acetamido-N-[2-(ethylamino)ethyl]acetamide is CCNCCNC(=O)CNC(C)=O.
What is the InChIKey of 2-acetamido-N-[2-(ethylamino)ethyl]acetamide?
The InChIKey is YTTDDUCXJGKROW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2/c1-3-9-4-5-10-8(13)6-11-7(2)12/h9H,3-6H2,1-2H3,(H,10,13)(H,11,12).
What are the key properties of 2-acetamido-N-[2-(ethylamino)ethyl]acetamide?
2-acetamido-N-[2-(ethylamino)ethyl]acetamide has a molecular weight of 187.24 g/mol, XLogP of -1.15, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[2-(ethylamino)ethyl]acetamide is sourced from PubChem (CID 62657470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).