2-[(3-aminocyclohexyl)amino]ethanol

C8H18N2O — CID 79459217

IUPAC2-[(3-aminocyclohexyl)amino]ethanol
SMILESNC1CCCC(NCCO)C1
InChIInChI=1S/C8H18N2O/c9-7-2-1-3-8(6-7)10-4-5-11/h7-8,10-11H,1-6,9H2
InChIKeyRVFIJUMEUAATLI-UHFFFAOYSA-N
MW158.24 g/mol
LogP-0.16
Rot. Bonds3

About 2-[(3-aminocyclohexyl)amino]ethanol

2-[(3-aminocyclohexyl)amino]ethanol (PubChem CID 79459217) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-[(3-aminocyclohexyl)amino]ethanol.

Molecular Properties

Compound Name2-[(3-aminocyclohexyl)amino]ethanol
PubChem CID79459217
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name2-[(3-aminocyclohexyl)amino]ethanol
SMILESNC1CCCC(NCCO)C1
InChIInChI=1S/C8H18N2O/c9-7-2-1-3-8(6-7)10-4-5-11/h7-8,10-11H,1-6,9H2
InChIKeyRVFIJUMEUAATLI-UHFFFAOYSA-N
XLogP-0.16
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(3-aminocyclohexyl)amino]hexan-1-ol
CID 107848750
5-[(3-aminocyclohexyl)amino]pentan-1-ol
CID 107316668
1-N-propylcyclohexane-1,3-diamine
CID 22026573
N-[2-[(3-aminocyclohexyl)amino]ethyl]acetamide
CID 79459016
2-[(3-aminocyclohexyl)amino]ethyl carbamate
CID 83202906
3-[(3-aminocyclohexyl)amino]propane-1,2-diol
CID 79458034
5-[(3-aminocyclohexyl)amino]pentan-2-ol
CID 106121477
methyl 3-[(3-aminocyclohexyl)amino]propanoate
CID 79458540
1-N-pent-4-ynylcyclohexane-1,3-diamine
CID 106220280
1-N-(2-methylsulfonylethyl)cyclohexane-1,3-diamine
CID 79459348
1-N-(3-methoxypropyl)cyclohexane-1,3-diamine
CID 79458917
1-N-(3-methylsulfanylpropyl)cyclohexane-1,3-diamine
CID 79459469

Frequently Asked Questions

What is the IUPAC name of 2-[(3-aminocyclohexyl)amino]ethanol?
The IUPAC name of 2-[(3-aminocyclohexyl)amino]ethanol (CID 79459217) is 2-[(3-aminocyclohexyl)amino]ethanol.
What is the SMILES notation for 2-[(3-aminocyclohexyl)amino]ethanol?
The canonical SMILES for 2-[(3-aminocyclohexyl)amino]ethanol is NC1CCCC(NCCO)C1.
What is the InChIKey of 2-[(3-aminocyclohexyl)amino]ethanol?
The InChIKey is RVFIJUMEUAATLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c9-7-2-1-3-8(6-7)10-4-5-11/h7-8,10-11H,1-6,9H2.
What are the key properties of 2-[(3-aminocyclohexyl)amino]ethanol?
2-[(3-aminocyclohexyl)amino]ethanol has a molecular weight of 158.24 g/mol, XLogP of -0.16, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-aminocyclohexyl)amino]ethanol is sourced from PubChem (CID 79459217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).