ethane;N-[(Z)-prop-1-enyl]propan-2-imine

C10H23N — CID 143701951

IUPACethane;N-[(Z)-prop-1-enyl]propan-2-imine
SMILESC/C=C\N=C(C)C.CC.CC
InChIInChI=1S/C6H11N.2C2H6/c1-4-5-7-6(2)3;2*1-2/h4-5H,1-3H3;2*1-2H3/b5-4-;;
InChIKeyKZCXOIDFWVKRBA-WNCVTPEDSA-N
MW157.30 g/mol
LogP4.05
Rot. Bonds1

About ethane;N-[(Z)-prop-1-enyl]propan-2-imine

ethane;N-[(Z)-prop-1-enyl]propan-2-imine (PubChem CID 143701951) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is ethane;N-[(Z)-prop-1-enyl]propan-2-imine.

Molecular Properties

Compound Nameethane;N-[(Z)-prop-1-enyl]propan-2-imine
PubChem CID143701951
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC Nameethane;N-[(Z)-prop-1-enyl]propan-2-imine
SMILESC/C=C\N=C(C)C.CC.CC
InChIInChI=1S/C6H11N.2C2H6/c1-4-5-7-6(2)3;2*1-2/h4-5H,1-3H3;2*1-2H3/b5-4-;;
InChIKeyKZCXOIDFWVKRBA-WNCVTPEDSA-N
XLogP4.05
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 ethane;N-[(Z)-prop-1-enyl]propan-2-imine?
The IUPAC name of ethane;N-[(Z)-prop-1-enyl]propan-2-imine (CID 143701951) is ethane;N-[(Z)-prop-1-enyl]propan-2-imine.
What is the SMILES notation for ethane;N-[(Z)-prop-1-enyl]propan-2-imine?
The canonical SMILES for ethane;N-[(Z)-prop-1-enyl]propan-2-imine is C/C=C\N=C(C)C.CC.CC.
What is the InChIKey of ethane;N-[(Z)-prop-1-enyl]propan-2-imine?
The InChIKey is KZCXOIDFWVKRBA-WNCVTPEDSA-N. The full InChI is InChI=1S/C6H11N.2C2H6/c1-4-5-7-6(2)3;2*1-2/h4-5H,1-3H3;2*1-2H3/b5-4-;;.
What are the key properties of ethane;N-[(Z)-prop-1-enyl]propan-2-imine?
ethane;N-[(Z)-prop-1-enyl]propan-2-imine has a molecular weight of 157.30 g/mol, XLogP of 4.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[(Z)-prop-1-enyl]propan-2-imine is sourced from PubChem (CID 143701951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).