4-(2-aminoethoxy)cyclohexan-1-amine

C8H18N2O — CID 64981454

IUPAC4-(2-aminoethoxy)cyclohexan-1-amine
SMILESNCCOC1CCC(N)CC1
InChIInChI=1S/C8H18N2O/c9-5-6-11-8-3-1-7(10)2-4-8/h7-8H,1-6,9-10H2
InChIKeyPFBKENQKBHPNDP-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.23
Rot. Bonds3

About 4-(2-aminoethoxy)cyclohexan-1-amine

4-(2-aminoethoxy)cyclohexan-1-amine (PubChem CID 64981454) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 4-(2-aminoethoxy)cyclohexan-1-amine.

Molecular Properties

Compound Name4-(2-aminoethoxy)cyclohexan-1-amine
PubChem CID64981454
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name4-(2-aminoethoxy)cyclohexan-1-amine
SMILESNCCOC1CCC(N)CC1
InChIInChI=1S/C8H18N2O/c9-5-6-11-8-3-1-7(10)2-4-8/h7-8H,1-6,9-10H2
InChIKeyPFBKENQKBHPNDP-UHFFFAOYSA-N
XLogP0.23
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethoxy)cyclohexan-1-amine?
The IUPAC name of 4-(2-aminoethoxy)cyclohexan-1-amine (CID 64981454) is 4-(2-aminoethoxy)cyclohexan-1-amine.
What is the SMILES notation for 4-(2-aminoethoxy)cyclohexan-1-amine?
The canonical SMILES for 4-(2-aminoethoxy)cyclohexan-1-amine is NCCOC1CCC(N)CC1.
What is the InChIKey of 4-(2-aminoethoxy)cyclohexan-1-amine?
The InChIKey is PFBKENQKBHPNDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c9-5-6-11-8-3-1-7(10)2-4-8/h7-8H,1-6,9-10H2.
What are the key properties of 4-(2-aminoethoxy)cyclohexan-1-amine?
4-(2-aminoethoxy)cyclohexan-1-amine has a molecular weight of 158.24 g/mol, XLogP of 0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethoxy)cyclohexan-1-amine is sourced from PubChem (CID 64981454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).