N-[(Z)-pent-1-enyl]propan-2-imine

C8H15N — CID 145467907

IUPACN-[(Z)-pent-1-enyl]propan-2-imine
SMILESCCC/C=C\N=C(C)C
InChIInChI=1S/C8H15N/c1-4-5-6-7-9-8(2)3/h6-7H,4-5H2,1-3H3/b7-6-
InChIKeyNRFHQRIRCFPPOV-SREVYHEPSA-N
MW125.21 g/mol
LogP2.78
Rot. Bonds3

About N-[(Z)-pent-1-enyl]propan-2-imine

N-[(Z)-pent-1-enyl]propan-2-imine (PubChem CID 145467907) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is N-[(Z)-pent-1-enyl]propan-2-imine.

Molecular Properties

Compound NameN-[(Z)-pent-1-enyl]propan-2-imine
PubChem CID145467907
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC NameN-[(Z)-pent-1-enyl]propan-2-imine
SMILESCCC/C=C\N=C(C)C
InChIInChI=1S/C8H15N/c1-4-5-6-7-9-8(2)3/h6-7H,4-5H2,1-3H3/b7-6-
InChIKeyNRFHQRIRCFPPOV-SREVYHEPSA-N
XLogP2.78
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[(Z)-but-1-enyl]propan-2-imine;ethane
CID 145419661
(Z)-N-methyl-3-(propan-2-ylideneamino)prop-2-en-1-amine
CID 167287780
(E)-1-nitrosopent-1-ene
CID 148875645
N-hex-2-enylpropan-2-imine
CID 123559715
4-methyl-3-N-(2-methylbutylidene)-2-N-[(E)-pent-1-enyl]pent-3-ene-2,3-diimine
CID 126599381
(4E,8E)-dodeca-4,8-diene
CID 12576905
(4Z,8E)-dodeca-4,8-diene
CID 12576906
ethane;(E)-oct-4-ene
CID 142055407
(Z)-2-(propan-2-ylideneamino)ethenol
CID 144930691
N-ethyl-N'-[(E)-pent-1-enyl]ethane-1,2-diimine
CID 123367431
sodium (E)-4-hydroxy-N-[(E)-oct-1-enyl]-4-oxobut-2-enimidate
CID 101277141
(3E)-2-methylhepta-1,3-diene
CID 12928201

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-pent-1-enyl]propan-2-imine?
The IUPAC name of N-[(Z)-pent-1-enyl]propan-2-imine (CID 145467907) is N-[(Z)-pent-1-enyl]propan-2-imine.
What is the SMILES notation for N-[(Z)-pent-1-enyl]propan-2-imine?
The canonical SMILES for N-[(Z)-pent-1-enyl]propan-2-imine is CCC/C=C\N=C(C)C.
What is the InChIKey of N-[(Z)-pent-1-enyl]propan-2-imine?
The InChIKey is NRFHQRIRCFPPOV-SREVYHEPSA-N. The full InChI is InChI=1S/C8H15N/c1-4-5-6-7-9-8(2)3/h6-7H,4-5H2,1-3H3/b7-6-.
What are the key properties of N-[(Z)-pent-1-enyl]propan-2-imine?
N-[(Z)-pent-1-enyl]propan-2-imine has a molecular weight of 125.21 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-pent-1-enyl]propan-2-imine is sourced from PubChem (CID 145467907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).