N-(2-aminoprop-2-enyl)acetamide;2-methylpropane

C9H20N2O — CID 144643638

IUPACN-(2-aminoprop-2-enyl)acetamide;2-methylpropane
SMILESC=C(N)CNC(C)=O.CC(C)C
InChIInChI=1S/C5H10N2O.C4H10/c1-4(6)3-7-5(2)8;1-4(2)3/h1,3,6H2,2H3,(H,7,8);4H,1-3H3
InChIKeyOKMKQAOPSSKNDC-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.26
Rot. Bonds2

About N-(2-aminoprop-2-enyl)acetamide;2-methylpropane

N-(2-aminoprop-2-enyl)acetamide;2-methylpropane (PubChem CID 144643638) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is N-(2-aminoprop-2-enyl)acetamide;2-methylpropane.

Molecular Properties

Compound NameN-(2-aminoprop-2-enyl)acetamide;2-methylpropane
PubChem CID144643638
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC NameN-(2-aminoprop-2-enyl)acetamide;2-methylpropane
SMILESC=C(N)CNC(C)=O.CC(C)C
InChIInChI=1S/C5H10N2O.C4H10/c1-4(6)3-7-5(2)8;1-4(2)3/h1,3,6H2,2H3,(H,7,8);4H,1-3H3
InChIKeyOKMKQAOPSSKNDC-UHFFFAOYSA-N
XLogP1.26
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(prop-1-en-2-ylamino)ethyl]acetamide
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4-Tert-butyl-5-methylidenepiperazin-2-one
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N-[4-(prop-1-en-2-ylamino)butyl]acetamide
CID 88972536
N-[(E)-4-(prop-1-en-2-ylamino)but-2-enyl]acetamide
CID 89227881
2-(prop-1-en-2-ylamino)-N-propylacetamide
CID 89933848
N-[2-[[(Z)-2-aminobut-1-enyl]amino]ethyl]acetamide
CID 90382326
N-methyl-N-[2-(methylamino)prop-2-enyl]butanamide
CID 90398268
N-(2-diazenylprop-2-enyl)acetamide
CID 90766582
N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide
CID 118358855
N-[3-(dimethylamino)but-3-en-2-yl]acetamide
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N-(2-aminoprop-2-enyl)-2-(but-1-en-2-ylamino)acetamide
CID 126589654

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoprop-2-enyl)acetamide;2-methylpropane?
The IUPAC name of N-(2-aminoprop-2-enyl)acetamide;2-methylpropane (CID 144643638) is N-(2-aminoprop-2-enyl)acetamide;2-methylpropane.
What is the SMILES notation for N-(2-aminoprop-2-enyl)acetamide;2-methylpropane?
The canonical SMILES for N-(2-aminoprop-2-enyl)acetamide;2-methylpropane is C=C(N)CNC(C)=O.CC(C)C.
What is the InChIKey of N-(2-aminoprop-2-enyl)acetamide;2-methylpropane?
The InChIKey is OKMKQAOPSSKNDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O.C4H10/c1-4(6)3-7-5(2)8;1-4(2)3/h1,3,6H2,2H3,(H,7,8);4H,1-3H3.
What are the key properties of N-(2-aminoprop-2-enyl)acetamide;2-methylpropane?
N-(2-aminoprop-2-enyl)acetamide;2-methylpropane has a molecular weight of 172.27 g/mol, XLogP of 1.26, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoprop-2-enyl)acetamide;2-methylpropane is sourced from PubChem (CID 144643638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).