N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide

C9H17N3O — CID 142959961

IUPACN-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide
SMILESCCN1C=C(CCNC(C)=O)NC1
InChIInChI=1S/C9H17N3O/c1-3-12-6-9(11-7-12)4-5-10-8(2)13/h6,11H,3-5,7H2,1-2H3,(H,10,13)
InChIKeyPAHJHHNQDIYGAT-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.24
Rot. Bonds4

About N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide

N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide (PubChem CID 142959961) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide
PubChem CID142959961
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC NameN-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide
SMILESCCN1C=C(CCNC(C)=O)NC1
InChIInChI=1S/C9H17N3O/c1-3-12-6-9(11-7-12)4-5-10-8(2)13/h6,11H,3-5,7H2,1-2H3,(H,10,13)
InChIKeyPAHJHHNQDIYGAT-UHFFFAOYSA-N
XLogP0.24
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dipropyl-1H-imidazol-2-one
CID 18384147
N-[2-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)ethyl]acetamide
CID 69029233
5-ethyl-3-propyl-1H-imidazol-2-one
CID 69521209
2-[3-(3-methylbutyl)-2-oxo-1H-imidazol-5-yl]propanamide
CID 71019090
2-[3-(3-methylbutyl)-2-oxo-1H-imidazol-5-yl]acetamide
CID 71019100
3,4-di(propan-2-yl)-1H-imidazol-2-one
CID 81446530
N-[3-(3-methyl-2H-imidazol-1-yl)propyl]acetamide
CID 89269343
N-[3-(ethenylamino)but-3-enyl]-N-propan-2-ylpropanamide
CID 130253197
(6Z)-1-ethyl-6-(ethylaminomethylidene)-1,3-diazinan-2-one
CID 142817934
N-[2-(3-methyl-1-propyl-2H-imidazol-4-yl)ethyl]acetamide
CID 142959966
N-[(Z)-3-amino-4-[ethyl(methyl)amino]but-3-enyl]acetamide
CID 142959970
acetylene;N-[(Z)-3-amino-4-[methyl(propan-2-yl)amino]but-3-enyl]acetamide
CID 142959973

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide?
The IUPAC name of N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide (CID 142959961) is N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide is CCN1C=C(CCNC(C)=O)NC1.
What is the InChIKey of N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide?
The InChIKey is PAHJHHNQDIYGAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-3-12-6-9(11-7-12)4-5-10-8(2)13/h6,11H,3-5,7H2,1-2H3,(H,10,13).
What are the key properties of N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide?
N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide has a molecular weight of 183.25 g/mol, XLogP of 0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide is sourced from PubChem (CID 142959961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).