N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine

C10H18N2 — CID 89298343

IUPACN-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine
SMILESC/C=C\N=C(/C)CN1CCCC1
InChIInChI=1S/C10H18N2/c1-3-6-11-10(2)9-12-7-4-5-8-12/h3,6H,4-5,7-9H2,1-2H3/b6-3-,11-10+
InChIKeyLZBVOZBPBVZZBS-CXTNCHIPSA-N
MW166.27 g/mol
LogP2.08
Rot. Bonds3

About N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine

N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine (PubChem CID 89298343) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine.

Molecular Properties

Compound NameN-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine
PubChem CID89298343
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC NameN-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine
SMILESC/C=C\N=C(/C)CN1CCCC1
InChIInChI=1S/C10H18N2/c1-3-6-11-10(2)9-12-7-4-5-8-12/h3,6H,4-5,7-9H2,1-2H3/b6-3-,11-10+
InChIKeyLZBVOZBPBVZZBS-CXTNCHIPSA-N
XLogP2.08
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine?
The IUPAC name of N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine (CID 89298343) is N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine.
What is the SMILES notation for N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine?
The canonical SMILES for N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine is C/C=C\N=C(/C)CN1CCCC1.
What is the InChIKey of N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine?
The InChIKey is LZBVOZBPBVZZBS-CXTNCHIPSA-N. The full InChI is InChI=1S/C10H18N2/c1-3-6-11-10(2)9-12-7-4-5-8-12/h3,6H,4-5,7-9H2,1-2H3/b6-3-,11-10+.
What are the key properties of N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine?
N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine has a molecular weight of 166.27 g/mol, XLogP of 2.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-prop-1-enyl]-1-pyrrolidin-1-ylpropan-2-imine is sourced from PubChem (CID 89298343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).