N-[2-(2-methylprop-2-enylamino)ethyl]acetamide

C8H16N2O — CID 60691853

IUPACN-[2-(2-methylprop-2-enylamino)ethyl]acetamide
SMILESC=C(C)CNCCNC(C)=O
InChIInChI=1S/C8H16N2O/c1-7(2)6-9-4-5-10-8(3)11/h9H,1,4-6H2,2-3H3,(H,10,11)
InChIKeyDSOYKBLOYCASRD-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.29
Rot. Bonds5

About N-[2-(2-methylprop-2-enylamino)ethyl]acetamide

N-[2-(2-methylprop-2-enylamino)ethyl]acetamide (PubChem CID 60691853) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-[2-(2-methylprop-2-enylamino)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2-methylprop-2-enylamino)ethyl]acetamide
PubChem CID60691853
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-[2-(2-methylprop-2-enylamino)ethyl]acetamide
SMILESC=C(C)CNCCNC(C)=O
InChIInChI=1S/C8H16N2O/c1-7(2)6-9-4-5-10-8(3)11/h9H,1,4-6H2,2-3H3,(H,10,11)
InChIKeyDSOYKBLOYCASRD-UHFFFAOYSA-N
XLogP0.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(prop-1-en-2-ylamino)ethyl]acetamide
CID 21030566
2-(2-acetamidoethylamino)-N-methyl-N-propan-2-ylacetamide
CID 43401676
N-[2-(ethylamino)ethyl]acetamide;propane
CID 159314545
N-[2-[2-[2-[2-(ethylamino)ethylamino]ethylamino]ethylamino]ethyl]acetamide
CID 88534902
2-(2-methylprop-2-enylamino)ethanol
CID 19100967
N-[2-(2,2,2-trifluoroethylamino)ethyl]acetamide
CID 43401592
(2-methylprop-2-enylamino)methanol
CID 19091971
N-(3-acetamidopropyl)acetamide
CID 5147555
N-[4-(4-acetamidobutylamino)butyl]acetamide
CID 10332037
N-[2-(methylamino)ethyl]acetamide;hydrochloride
CID 75480326
3-acetamidopropanoyloxidanium
CID 154009858
N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide
CID 43807754

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylprop-2-enylamino)ethyl]acetamide?
The IUPAC name of N-[2-(2-methylprop-2-enylamino)ethyl]acetamide (CID 60691853) is N-[2-(2-methylprop-2-enylamino)ethyl]acetamide.
What is the SMILES notation for N-[2-(2-methylprop-2-enylamino)ethyl]acetamide?
The canonical SMILES for N-[2-(2-methylprop-2-enylamino)ethyl]acetamide is C=C(C)CNCCNC(C)=O.
What is the InChIKey of N-[2-(2-methylprop-2-enylamino)ethyl]acetamide?
The InChIKey is DSOYKBLOYCASRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-7(2)6-9-4-5-10-8(3)11/h9H,1,4-6H2,2-3H3,(H,10,11).
What are the key properties of N-[2-(2-methylprop-2-enylamino)ethyl]acetamide?
N-[2-(2-methylprop-2-enylamino)ethyl]acetamide has a molecular weight of 156.23 g/mol, XLogP of 0.29, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylprop-2-enylamino)ethyl]acetamide is sourced from PubChem (CID 60691853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).