N-ethyl-3-[methyl(propan-2-yl)amino]propanamide

C9H20N2O — CID 163565959

IUPACN-ethyl-3-[methyl(propan-2-yl)amino]propanamide
SMILESCCNC(=O)CCN(C)C(C)C
InChIInChI=1S/C9H20N2O/c1-5-10-9(12)6-7-11(4)8(2)3/h8H,5-7H2,1-4H3,(H,10,12)
InChIKeyFVFAXDJUOWCJSV-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.85
Rot. Bonds5

About N-ethyl-3-[methyl(propan-2-yl)amino]propanamide

N-ethyl-3-[methyl(propan-2-yl)amino]propanamide (PubChem CID 163565959) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is N-ethyl-3-[methyl(propan-2-yl)amino]propanamide.

Molecular Properties

Compound NameN-ethyl-3-[methyl(propan-2-yl)amino]propanamide
PubChem CID163565959
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC NameN-ethyl-3-[methyl(propan-2-yl)amino]propanamide
SMILESCCNC(=O)CCN(C)C(C)C
InChIInChI=1S/C9H20N2O/c1-5-10-9(12)6-7-11(4)8(2)3/h8H,5-7H2,1-4H3,(H,10,12)
InChIKeyFVFAXDJUOWCJSV-UHFFFAOYSA-N
XLogP0.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[methyl(propan-2-yl)amino]-N-propylpropanamide
CID 170366588
N-(2-hydroxyethyl)-3-[methyl(propan-2-yl)amino]propanamide
CID 169177259
N-ethyl-3-[2-hydroxyethyl(propan-2-yl)amino]propanamide
CID 62326642
ethyl 3-[[3-(ethylamino)-3-oxopropyl]-methylamino]propanoate
CID 62326480
3-[[(1R)-1-(2,5-dimethyl-1,3-thiazol-4-yl)ethyl]-methylamino]-N-ethylpropanamide
CID 124855101
3-[di(propanoyl)amino]-N-ethylpropanamide
CID 156628705
3-[ethyl-[3-(ethylamino)-3-oxopropyl]amino]butanoic acid
CID 62827272
7-amino-N-[2-[methyl(propan-2-yl)amino]ethyl]heptanamide
CID 62642436
N,N'-diethylnonanediamide
CID 89048639
2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide
CID 62642701
ethyl (2R)-2-amino-5-(ethylamino)-5-oxopentanoate
CID 71815737
2-[2-[methyl(propan-2-yl)amino]ethylamino]butanoic acid
CID 64667381

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[methyl(propan-2-yl)amino]propanamide?
The IUPAC name of N-ethyl-3-[methyl(propan-2-yl)amino]propanamide (CID 163565959) is N-ethyl-3-[methyl(propan-2-yl)amino]propanamide.
What is the SMILES notation for N-ethyl-3-[methyl(propan-2-yl)amino]propanamide?
The canonical SMILES for N-ethyl-3-[methyl(propan-2-yl)amino]propanamide is CCNC(=O)CCN(C)C(C)C.
What is the InChIKey of N-ethyl-3-[methyl(propan-2-yl)amino]propanamide?
The InChIKey is FVFAXDJUOWCJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-5-10-9(12)6-7-11(4)8(2)3/h8H,5-7H2,1-4H3,(H,10,12).
What are the key properties of N-ethyl-3-[methyl(propan-2-yl)amino]propanamide?
N-ethyl-3-[methyl(propan-2-yl)amino]propanamide has a molecular weight of 172.27 g/mol, XLogP of 0.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[methyl(propan-2-yl)amino]propanamide is sourced from PubChem (CID 163565959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).