N-[2-(1-methylcyclopropyl)ethyl]ethanimine

C8H15N — CID 163453088

IUPACN-[2-(1-methylcyclopropyl)ethyl]ethanimine
SMILESC/C=N/CCC1(C)CC1
InChIInChI=1S/C8H15N/c1-3-9-7-6-8(2)4-5-8/h3H,4-7H2,1-2H3/b9-3+
InChIKeyBIDZEHWOYUOFNX-YCRREMRBSA-N
MW125.21 g/mol
LogP2.27
Rot. Bonds3

About N-[2-(1-methylcyclopropyl)ethyl]ethanimine

N-[2-(1-methylcyclopropyl)ethyl]ethanimine (PubChem CID 163453088) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is N-[2-(1-methylcyclopropyl)ethyl]ethanimine.

Molecular Properties

Compound NameN-[2-(1-methylcyclopropyl)ethyl]ethanimine
PubChem CID163453088
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC NameN-[2-(1-methylcyclopropyl)ethyl]ethanimine
SMILESC/C=N/CCC1(C)CC1
InChIInChI=1S/C8H15N/c1-3-9-7-6-8(2)4-5-8/h3H,4-7H2,1-2H3/b9-3+
InChIKeyBIDZEHWOYUOFNX-YCRREMRBSA-N
XLogP2.27
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 ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[2-(1-methylcyclopropyl)ethyl]ethanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylcyclopropyl)ethyl]ethanimine?
The IUPAC name of N-[2-(1-methylcyclopropyl)ethyl]ethanimine (CID 163453088) is N-[2-(1-methylcyclopropyl)ethyl]ethanimine.
What is the SMILES notation for N-[2-(1-methylcyclopropyl)ethyl]ethanimine?
The canonical SMILES for N-[2-(1-methylcyclopropyl)ethyl]ethanimine is C/C=N/CCC1(C)CC1.
What is the InChIKey of N-[2-(1-methylcyclopropyl)ethyl]ethanimine?
The InChIKey is BIDZEHWOYUOFNX-YCRREMRBSA-N. The full InChI is InChI=1S/C8H15N/c1-3-9-7-6-8(2)4-5-8/h3H,4-7H2,1-2H3/b9-3+.
What are the key properties of N-[2-(1-methylcyclopropyl)ethyl]ethanimine?
N-[2-(1-methylcyclopropyl)ethyl]ethanimine has a molecular weight of 125.21 g/mol, XLogP of 2.27, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylcyclopropyl)ethyl]ethanimine is sourced from PubChem (CID 163453088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).