N',1-dicyclopentyl-N'-ethylethane-1,2-diamine

C14H28N2 — CID 104744779

IUPACN',1-dicyclopentyl-N'-ethylethane-1,2-diamine
SMILESCCN(CC(N)C1CCCC1)C1CCCC1
InChIInChI=1S/C14H28N2/c1-2-16(13-9-5-6-10-13)11-14(15)12-7-3-4-8-12/h12-14H,2-11,15H2,1H3
InChIKeyOVMOJBWHBQMHTM-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.77
Rot. Bonds5

About N',1-dicyclopentyl-N'-ethylethane-1,2-diamine

N',1-dicyclopentyl-N'-ethylethane-1,2-diamine (PubChem CID 104744779) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N',1-dicyclopentyl-N'-ethylethane-1,2-diamine.

Molecular Properties

Compound NameN',1-dicyclopentyl-N'-ethylethane-1,2-diamine
PubChem CID104744779
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN',1-dicyclopentyl-N'-ethylethane-1,2-diamine
SMILESCCN(CC(N)C1CCCC1)C1CCCC1
InChIInChI=1S/C14H28N2/c1-2-16(13-9-5-6-10-13)11-14(15)12-7-3-4-8-12/h12-14H,2-11,15H2,1H3
InChIKeyOVMOJBWHBQMHTM-UHFFFAOYSA-N
XLogP2.77
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-N'-cyclopentyl-N'-ethylethane-1,2-diamine
CID 104744777
1-N-cyclohexyl-1-N-ethylbutane-1,2-diamine
CID 43649724
1-N-cyclopentyl-1-N-ethyl-4-methylpentane-1,2-diamine
CID 43541297
N',1-dicyclopropyl-N'-propylethane-1,2-diamine
CID 63912333
N'-cyclopentyl-1-cyclopropyl-N'-methylethane-1,2-diamine
CID 63914724
1-amino-3-[cyclopentyl(ethyl)amino]propan-2-ol
CID 43541005
N,N-diethylcycloundecanamine
CID 163828609
1-[cyclopentyl(ethyl)amino]butan-2-ol
CID 60886562
N'-cyclopentyl-N'-ethyl-2-propan-2-ylpropane-1,3-diamine
CID 65228278
N'-cyclohexyl-1-cyclopropyl-N'-ethyl-N-methylethane-1,2-diamine
CID 63912104
1-N-cyclopropyl-1-N-ethylbutane-1,2-diamine
CID 43649749
1-N-cyclohexyl-1-N-ethyl-3-methoxy-3-methylbutane-1,2-diamine
CID 114228399

Frequently Asked Questions

What is the IUPAC name of N',1-dicyclopentyl-N'-ethylethane-1,2-diamine?
The IUPAC name of N',1-dicyclopentyl-N'-ethylethane-1,2-diamine (CID 104744779) is N',1-dicyclopentyl-N'-ethylethane-1,2-diamine.
What is the SMILES notation for N',1-dicyclopentyl-N'-ethylethane-1,2-diamine?
The canonical SMILES for N',1-dicyclopentyl-N'-ethylethane-1,2-diamine is CCN(CC(N)C1CCCC1)C1CCCC1.
What is the InChIKey of N',1-dicyclopentyl-N'-ethylethane-1,2-diamine?
The InChIKey is OVMOJBWHBQMHTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-2-16(13-9-5-6-10-13)11-14(15)12-7-3-4-8-12/h12-14H,2-11,15H2,1H3.
What are the key properties of N',1-dicyclopentyl-N'-ethylethane-1,2-diamine?
N',1-dicyclopentyl-N'-ethylethane-1,2-diamine has a molecular weight of 224.39 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',1-dicyclopentyl-N'-ethylethane-1,2-diamine is sourced from PubChem (CID 104744779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).