2-[tert-butyl(ethyl)amino]propanamide

C9H20N2O — CID 82040439

IUPAC2-[tert-butyl(ethyl)amino]propanamide
SMILESCCN(C(C)C(N)=O)C(C)(C)C
InChIInChI=1S/C9H20N2O/c1-6-11(9(3,4)5)7(2)8(10)12/h7H,6H2,1-5H3,(H2,10,12)
InChIKeyNUSWEFRXPAHPAP-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.98
Rot. Bonds3

About 2-[tert-butyl(ethyl)amino]propanamide

2-[tert-butyl(ethyl)amino]propanamide (PubChem CID 82040439) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-[tert-butyl(ethyl)amino]propanamide.

Molecular Properties

Compound Name2-[tert-butyl(ethyl)amino]propanamide
PubChem CID82040439
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-[tert-butyl(ethyl)amino]propanamide
SMILESCCN(C(C)C(N)=O)C(C)(C)C
InChIInChI=1S/C9H20N2O/c1-6-11(9(3,4)5)7(2)8(10)12/h7H,6H2,1-5H3,(H2,10,12)
InChIKeyNUSWEFRXPAHPAP-UHFFFAOYSA-N
XLogP0.98
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[bis(2-hydroxyacetyl)amino]propanamide
CID 141435220
ethane;2-[ethyl(methyl)amino]propanamide
CID 176567778
2-N-tert-butyl-2-N-ethylpropane-1,2-diamine
CID 131224561
2-[tert-butyl(ethyl)amino]propan-1-ol
CID 131224515
2-[(1-amino-1-oxobutan-2-yl)-tert-butylamino]acetic acid
CID 79268327
2-(dipropylamino)propanamide
CID 18474126
2-[1-(dimethylamino)propan-2-yl-ethylamino]propanamide
CID 103190759
3-[(1-amino-1-oxopropan-2-yl)-ethylamino]-2-methylpropanoic acid
CID 62853683
tert-butyl N-[(2S)-1-amino-1-oxopropan-2-yl]-N-propylcarbamate
CID 89116741
2-[butyl(methyl)amino]propanamide
CID 60644986
2-[tert-butyl(ethyl)amino]propanenitrile
CID 130756537
2-[(1-amino-1-oxopropan-2-yl)-butan-2-ylamino]acetic acid
CID 60833253

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(ethyl)amino]propanamide?
The IUPAC name of 2-[tert-butyl(ethyl)amino]propanamide (CID 82040439) is 2-[tert-butyl(ethyl)amino]propanamide.
What is the SMILES notation for 2-[tert-butyl(ethyl)amino]propanamide?
The canonical SMILES for 2-[tert-butyl(ethyl)amino]propanamide is CCN(C(C)C(N)=O)C(C)(C)C.
What is the InChIKey of 2-[tert-butyl(ethyl)amino]propanamide?
The InChIKey is NUSWEFRXPAHPAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-6-11(9(3,4)5)7(2)8(10)12/h7H,6H2,1-5H3,(H2,10,12).
What are the key properties of 2-[tert-butyl(ethyl)amino]propanamide?
2-[tert-butyl(ethyl)amino]propanamide has a molecular weight of 172.27 g/mol, XLogP of 0.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(ethyl)amino]propanamide is sourced from PubChem (CID 82040439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).