(E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine

C9H15N — CID 87403728

IUPAC(E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine
SMILESC=CCN(/C=C/C)CC=C
InChIInChI=1S/C9H15N/c1-4-7-10(8-5-2)9-6-3/h4-6,9H,1-2,7-8H2,3H3/b9-6+
InChIKeyHQXOVNJDGSMRNK-RMKNXTFCSA-N
MW137.23 g/mol
LogP2.19
Rot. Bonds5

About (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine

(E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine (PubChem CID 87403728) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine.

Molecular Properties

Compound Name(E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine
PubChem CID87403728
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name(E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine
SMILESC=CCN(/C=C/C)CC=C
InChIInChI=1S/C9H15N/c1-4-7-10(8-5-2)9-6-3/h4-6,9H,1-2,7-8H2,3H3/b9-6+
InChIKeyHQXOVNJDGSMRNK-RMKNXTFCSA-N
XLogP2.19
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine?
The IUPAC name of (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine (CID 87403728) is (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine.
What is the SMILES notation for (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine?
The canonical SMILES for (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine is C=CCN(/C=C/C)CC=C.
What is the InChIKey of (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine?
The InChIKey is HQXOVNJDGSMRNK-RMKNXTFCSA-N. The full InChI is InChI=1S/C9H15N/c1-4-7-10(8-5-2)9-6-3/h4-6,9H,1-2,7-8H2,3H3/b9-6+.
What are the key properties of (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine?
(E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine has a molecular weight of 137.23 g/mol, XLogP of 2.19, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-bis(prop-2-enyl)prop-1-en-1-amine is sourced from PubChem (CID 87403728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).