N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine

C11H20N2 — CID 118426098

IUPACN-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine
SMILESC=C(CNC1CCCCC1)/N=C/C
InChIInChI=1S/C11H20N2/c1-3-12-10(2)9-13-11-7-5-4-6-8-11/h3,11,13H,2,4-9H2,1H3/b12-3+
InChIKeySISWXIITOGHHDK-KGVSQERTSA-N
MW180.30 g/mol
LogP2.51
Rot. Bonds4

About N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine

N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine (PubChem CID 118426098) has the molecular formula C11H20N2 and a molecular weight of 180.30 g/mol. Its IUPAC name is N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine.

Molecular Properties

Compound NameN-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine
PubChem CID118426098
Molecular FormulaC11H20N2
Molecular Weight180.30 g/mol
Exact Mass180.16
IUPAC NameN-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine
SMILESC=C(CNC1CCCCC1)/N=C/C
InChIInChI=1S/C11H20N2/c1-3-12-10(2)9-13-11-7-5-4-6-8-11/h3,11,13H,2,4-9H2,1H3/b12-3+
InChIKeySISWXIITOGHHDK-KGVSQERTSA-N
XLogP2.51
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.30
LogP ≤ 52.51
H-Bond Donors ≤ 51
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-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine?
The IUPAC name of N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine (CID 118426098) is N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine.
What is the SMILES notation for N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine?
The canonical SMILES for N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine is C=C(CNC1CCCCC1)/N=C/C.
What is the InChIKey of N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine?
The InChIKey is SISWXIITOGHHDK-KGVSQERTSA-N. The full InChI is InChI=1S/C11H20N2/c1-3-12-10(2)9-13-11-7-5-4-6-8-11/h3,11,13H,2,4-9H2,1H3/b12-3+.
What are the key properties of N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine?
N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine has a molecular weight of 180.30 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylideneamino)prop-2-enyl]cyclohexanamine is sourced from PubChem (CID 118426098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).