N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide

C11H20N2O — CID 104655408

IUPACN-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide
SMILESC=CCCC(C)NCC(=O)NC1CC1
InChIInChI=1S/C11H20N2O/c1-3-4-5-9(2)12-8-11(14)13-10-6-7-10/h3,9-10,12H,1,4-8H2,2H3,(H,13,14)
InChIKeyPAQRMBOLUZIAIV-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.21
Rot. Bonds7

About N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide

N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide (PubChem CID 104655408) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide
PubChem CID104655408
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide
SMILESC=CCCC(C)NCC(=O)NC1CC1
InChIInChI=1S/C11H20N2O/c1-3-4-5-9(2)12-8-11(14)13-10-6-7-10/h3,9-10,12H,1,4-8H2,2H3,(H,13,14)
InChIKeyPAQRMBOLUZIAIV-UHFFFAOYSA-N
XLogP1.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide?
The IUPAC name of N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide (CID 104655408) is N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide?
The canonical SMILES for N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide is C=CCCC(C)NCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide?
The InChIKey is PAQRMBOLUZIAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-4-5-9(2)12-8-11(14)13-10-6-7-10/h3,9-10,12H,1,4-8H2,2H3,(H,13,14).
What are the key properties of N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide?
N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide has a molecular weight of 196.29 g/mol, XLogP of 1.21, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(hex-5-en-2-ylamino)acetamide is sourced from PubChem (CID 104655408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).