N-(4-aminopent-4-enyl)acetamide

C7H14N2O — CID 143017090

IUPACN-(4-aminopent-4-enyl)acetamide
SMILESC=C(N)CCCNC(C)=O
InChIInChI=1S/C7H14N2O/c1-6(8)4-3-5-9-7(2)10/h1,3-5,8H2,2H3,(H,9,10)
InChIKeyMJIMMSDXZSODKZ-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.38
Rot. Bonds4

About N-(4-aminopent-4-enyl)acetamide

N-(4-aminopent-4-enyl)acetamide (PubChem CID 143017090) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N-(4-aminopent-4-enyl)acetamide.

Molecular Properties

Compound NameN-(4-aminopent-4-enyl)acetamide
PubChem CID143017090
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN-(4-aminopent-4-enyl)acetamide
SMILESC=C(N)CCCNC(C)=O
InChIInChI=1S/C7H14N2O/c1-6(8)4-3-5-9-7(2)10/h1,3-5,8H2,2H3,(H,9,10)
InChIKeyMJIMMSDXZSODKZ-UHFFFAOYSA-N
XLogP0.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminopent-4-enyl)acetamide?
The IUPAC name of N-(4-aminopent-4-enyl)acetamide (CID 143017090) is N-(4-aminopent-4-enyl)acetamide.
What is the SMILES notation for N-(4-aminopent-4-enyl)acetamide?
The canonical SMILES for N-(4-aminopent-4-enyl)acetamide is C=C(N)CCCNC(C)=O.
What is the InChIKey of N-(4-aminopent-4-enyl)acetamide?
The InChIKey is MJIMMSDXZSODKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-6(8)4-3-5-9-7(2)10/h1,3-5,8H2,2H3,(H,9,10).
What are the key properties of N-(4-aminopent-4-enyl)acetamide?
N-(4-aminopent-4-enyl)acetamide has a molecular weight of 142.20 g/mol, XLogP of 0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminopent-4-enyl)acetamide is sourced from PubChem (CID 143017090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).