N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide

C11H18N2O — CID 54818176

IUPACN,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide
SMILESC=CCNCC(=O)N(CC=C)CC=C
InChIInChI=1S/C11H18N2O/c1-4-7-12-10-11(14)13(8-5-2)9-6-3/h4-6,12H,1-3,7-10H2
InChIKeyWSXUCJRPSBVIFX-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.96
Rot. Bonds8

About N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide

N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide (PubChem CID 54818176) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide
PubChem CID54818176
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide
SMILESC=CCNCC(=O)N(CC=C)CC=C
InChIInChI=1S/C11H18N2O/c1-4-7-12-10-11(14)13(8-5-2)9-6-3/h4-6,12H,1-3,7-10H2
InChIKeyWSXUCJRPSBVIFX-UHFFFAOYSA-N
XLogP0.96
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide?
The IUPAC name of N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide (CID 54818176) is N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide.
What is the SMILES notation for N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide?
The canonical SMILES for N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide is C=CCNCC(=O)N(CC=C)CC=C.
What is the InChIKey of N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide?
The InChIKey is WSXUCJRPSBVIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-4-7-12-10-11(14)13(8-5-2)9-6-3/h4-6,12H,1-3,7-10H2.
What are the key properties of N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide?
N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide has a molecular weight of 194.28 g/mol, XLogP of 0.96, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)-2-(prop-2-enylamino)acetamide is sourced from PubChem (CID 54818176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).