N-pent-2-enyl-N-prop-2-enylformamide

C9H15NO — CID 91119255

IUPACN-pent-2-enyl-N-prop-2-enylformamide
SMILESC=CCN(C=O)CC=CCC
InChIInChI=1S/C9H15NO/c1-3-5-6-8-10(9-11)7-4-2/h4-6,9H,2-3,7-8H2,1H3
InChIKeyGTHDRZQJDLUABD-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.60
Rot. Bonds6

About N-pent-2-enyl-N-prop-2-enylformamide

N-pent-2-enyl-N-prop-2-enylformamide (PubChem CID 91119255) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N-pent-2-enyl-N-prop-2-enylformamide.

Molecular Properties

Compound NameN-pent-2-enyl-N-prop-2-enylformamide
PubChem CID91119255
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN-pent-2-enyl-N-prop-2-enylformamide
SMILESC=CCN(C=O)CC=CCC
InChIInChI=1S/C9H15NO/c1-3-5-6-8-10(9-11)7-4-2/h4-6,9H,2-3,7-8H2,1H3
InChIKeyGTHDRZQJDLUABD-UHFFFAOYSA-N
XLogP1.60
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-pent-2-enyl-N-prop-2-enylformamide?
The IUPAC name of N-pent-2-enyl-N-prop-2-enylformamide (CID 91119255) is N-pent-2-enyl-N-prop-2-enylformamide.
What is the SMILES notation for N-pent-2-enyl-N-prop-2-enylformamide?
The canonical SMILES for N-pent-2-enyl-N-prop-2-enylformamide is C=CCN(C=O)CC=CCC.
What is the InChIKey of N-pent-2-enyl-N-prop-2-enylformamide?
The InChIKey is GTHDRZQJDLUABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-3-5-6-8-10(9-11)7-4-2/h4-6,9H,2-3,7-8H2,1H3.
What are the key properties of N-pent-2-enyl-N-prop-2-enylformamide?
N-pent-2-enyl-N-prop-2-enylformamide has a molecular weight of 153.22 g/mol, XLogP of 1.60, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-pent-2-enyl-N-prop-2-enylformamide is sourced from PubChem (CID 91119255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).