N,N-bis(prop-2-enyl)oxetan-3-amine

C9H15NO — CID 118174858

IUPACN,N-bis(prop-2-enyl)oxetan-3-amine
SMILESC=CCN(CC=C)C1COC1
InChIInChI=1S/C9H15NO/c1-3-5-10(6-4-2)9-7-11-8-9/h3-4,9H,1-2,5-8H2
InChIKeyNMXAHJYNPPNHCM-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.06
Rot. Bonds5

About N,N-bis(prop-2-enyl)oxetan-3-amine

N,N-bis(prop-2-enyl)oxetan-3-amine (PubChem CID 118174858) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)oxetan-3-amine.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)oxetan-3-amine
PubChem CID118174858
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN,N-bis(prop-2-enyl)oxetan-3-amine
SMILESC=CCN(CC=C)C1COC1
InChIInChI=1S/C9H15NO/c1-3-5-10(6-4-2)9-7-11-8-9/h3-4,9H,1-2,5-8H2
InChIKeyNMXAHJYNPPNHCM-UHFFFAOYSA-N
XLogP1.06
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.06
H-Bond Donors ≤ 50
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,N-bis(prop-2-enyl)oxetan-3-amine?
The IUPAC name of N,N-bis(prop-2-enyl)oxetan-3-amine (CID 118174858) is N,N-bis(prop-2-enyl)oxetan-3-amine.
What is the SMILES notation for N,N-bis(prop-2-enyl)oxetan-3-amine?
The canonical SMILES for N,N-bis(prop-2-enyl)oxetan-3-amine is C=CCN(CC=C)C1COC1.
What is the InChIKey of N,N-bis(prop-2-enyl)oxetan-3-amine?
The InChIKey is NMXAHJYNPPNHCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-3-5-10(6-4-2)9-7-11-8-9/h3-4,9H,1-2,5-8H2.
What are the key properties of N,N-bis(prop-2-enyl)oxetan-3-amine?
N,N-bis(prop-2-enyl)oxetan-3-amine has a molecular weight of 153.22 g/mol, XLogP of 1.06, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)oxetan-3-amine is sourced from PubChem (CID 118174858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).