2-amino-N-propylpropanamide;ethane

C8H20N2O — CID 142837247

IUPAC2-amino-N-propylpropanamide;ethane
SMILESCC.CCCNC(=O)C(C)N
InChIInChI=1S/C6H14N2O.C2H6/c1-3-4-8-6(9)5(2)7;1-2/h5H,3-4,7H2,1-2H3,(H,8,9);1-2H3
InChIKeyDKIDFFPJHFPHIB-UHFFFAOYSA-N
MW160.26 g/mol
LogP0.89
Rot. Bonds3

About 2-amino-N-propylpropanamide;ethane

2-amino-N-propylpropanamide;ethane (PubChem CID 142837247) has the molecular formula C8H20N2O and a molecular weight of 160.26 g/mol. Its IUPAC name is 2-amino-N-propylpropanamide;ethane.

Molecular Properties

Compound Name2-amino-N-propylpropanamide;ethane
PubChem CID142837247
Molecular FormulaC8H20N2O
Molecular Weight160.26 g/mol
Exact Mass160.16
IUPAC Name2-amino-N-propylpropanamide;ethane
SMILESCC.CCCNC(=O)C(C)N
InChIInChI=1S/C6H14N2O.C2H6/c1-3-4-8-6(9)5(2)7;1-2/h5H,3-4,7H2,1-2H3,(H,8,9);1-2H3
InChIKeyDKIDFFPJHFPHIB-UHFFFAOYSA-N
XLogP0.89
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-butyl(113C)propanamide
CID 157365112
(2S)-2-amino-N-butylpropan(15N)amide
CID 158456310
(2S)-2-amino-N-[2-[[(2S)-2-aminopropanoyl]amino]ethyl]propanamide;dihydrochloride
CID 18651575
2-amino-3-methyl-N-propylbutanamide;ethane
CID 143224871
(2R)-2-amino-N-(2-fluoroethyl)propanamide
CID 90216538
(2S)-2-amino-N-(2-chloroethyl)propanamide
CID 55302965
2-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]propanamide
CID 106236536
2-amino-N-propylpentanamide
CID 43649977
(2S)-2-amino-N-[2-[2-[[(2S)-2-aminopropanoyl]amino]ethyldisulfanyl]ethyl]propanamide
CID 18631474
2-iodo-N-propylpropanamide
CID 64787589
ethane;(2S)-2,3,3-trimethyl-N-propylbutanamide
CID 143641888
(2R)-2-amino-N-(4-hydroxybutyl)propanamide
CID 106842086

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-propylpropanamide;ethane?
The IUPAC name of 2-amino-N-propylpropanamide;ethane (CID 142837247) is 2-amino-N-propylpropanamide;ethane.
What is the SMILES notation for 2-amino-N-propylpropanamide;ethane?
The canonical SMILES for 2-amino-N-propylpropanamide;ethane is CC.CCCNC(=O)C(C)N.
What is the InChIKey of 2-amino-N-propylpropanamide;ethane?
The InChIKey is DKIDFFPJHFPHIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O.C2H6/c1-3-4-8-6(9)5(2)7;1-2/h5H,3-4,7H2,1-2H3,(H,8,9);1-2H3.
What are the key properties of 2-amino-N-propylpropanamide;ethane?
2-amino-N-propylpropanamide;ethane has a molecular weight of 160.26 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-propylpropanamide;ethane is sourced from PubChem (CID 142837247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).