N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine

C14H30N2O — CID 112591848

IUPACN'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine
SMILESCC(C)(C)OCCN(CCN)C1CCCCC1
InChIInChI=1S/C14H30N2O/c1-14(2,3)17-12-11-16(10-9-15)13-7-5-4-6-8-13/h13H,4-12,15H2,1-3H3
InChIKeyKVJWNRZYMRRZEM-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.39
Rot. Bonds6

About N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine

N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine (PubChem CID 112591848) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine
PubChem CID112591848
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine
SMILESCC(C)(C)OCCN(CCN)C1CCCCC1
InChIInChI=1S/C14H30N2O/c1-14(2,3)17-12-11-16(10-9-15)13-7-5-4-6-8-13/h13H,4-12,15H2,1-3H3
InChIKeyKVJWNRZYMRRZEM-UHFFFAOYSA-N
XLogP2.39
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-cyclohexyl-N'-(2-propan-2-yloxyethyl)ethane-1,2-diamine
CID 63759697
N'-cyclohexyl-N'-propylethane-1,2-diamine
CID 61348599
N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine
CID 104561146
N'-cyclobutyl-N'-[2-(3-methoxypropoxy)ethyl]ethane-1,2-diamine
CID 103184116
N'-cyclohexyl-N'-hexylethane-1,2-diamine
CID 63760462
N-[2-(2-aminoethoxy)ethyl]-N-ethylcyclohexanamine
CID 19098628
N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine
CID 63761677
2-(aminomethyl)-N-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclohexan-1-amine
CID 112590913
1-[2-aminoethyl(cyclohexyl)amino]propan-2-ol
CID 65279530
N'-cycloheptyl-N'-[3-(2,2,2-trifluoroethoxy)propyl]propane-1,3-diamine
CID 61491075
N'-cyclopropyl-N'-[2-(2-methylpropoxy)ethyl]ethane-1,2-diamine
CID 106450873
N-(2-chloroethyl)-N-[2-(trifluoromethoxy)ethyl]cyclobutanamine
CID 102861416

Frequently Asked Questions

What is the IUPAC name of N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine?
The IUPAC name of N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine (CID 112591848) is N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine is CC(C)(C)OCCN(CCN)C1CCCCC1.
What is the InChIKey of N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine?
The InChIKey is KVJWNRZYMRRZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-14(2,3)17-12-11-16(10-9-15)13-7-5-4-6-8-13/h13H,4-12,15H2,1-3H3.
What are the key properties of N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine?
N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine has a molecular weight of 242.41 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine is sourced from PubChem (CID 112591848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).