N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine

C12H24N2 — CID 170048476

IUPACN'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine
SMILESC=C(NCCN)C1CCC(CC)CC1
InChIInChI=1S/C12H24N2/c1-3-11-4-6-12(7-5-11)10(2)14-9-8-13/h11-12,14H,2-9,13H2,1H3
InChIKeyIOYNNHNOSNLVIS-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.26
Rot. Bonds5

About N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine

N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine (PubChem CID 170048476) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine
PubChem CID170048476
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine
SMILESC=C(NCCN)C1CCC(CC)CC1
InChIInChI=1S/C12H24N2/c1-3-11-4-6-12(7-5-11)10(2)14-9-8-13/h11-12,14H,2-9,13H2,1H3
InChIKeyIOYNNHNOSNLVIS-UHFFFAOYSA-N
XLogP2.26
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine?
The IUPAC name of N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine (CID 170048476) is N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine.
What is the SMILES notation for N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine?
The canonical SMILES for N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine is C=C(NCCN)C1CCC(CC)CC1.
What is the InChIKey of N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine?
The InChIKey is IOYNNHNOSNLVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-3-11-4-6-12(7-5-11)10(2)14-9-8-13/h11-12,14H,2-9,13H2,1H3.
What are the key properties of N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine?
N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine has a molecular weight of 196.34 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-(4-ethylcyclohexyl)ethenyl]ethane-1,2-diamine is sourced from PubChem (CID 170048476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).