1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol

C9H20N2O — CID 65213032

IUPAC1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol
SMILESCN(CCN)CC1(O)CCCC1
InChIInChI=1S/C9H20N2O/c1-11(7-6-10)8-9(12)4-2-3-5-9/h12H,2-8,10H2,1H3
InChIKeyZOIHNLNNZYYJSC-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.18
Rot. Bonds4

About 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol

1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol (PubChem CID 65213032) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol
PubChem CID65213032
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol
SMILESCN(CCN)CC1(O)CCCC1
InChIInChI=1S/C9H20N2O/c1-11(7-6-10)8-9(12)4-2-3-5-9/h12H,2-8,10H2,1H3
InChIKeyZOIHNLNNZYYJSC-UHFFFAOYSA-N
XLogP0.18
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol (CID 65213032) is 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol is CN(CCN)CC1(O)CCCC1.
What is the InChIKey of 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is ZOIHNLNNZYYJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-11(7-6-10)8-9(12)4-2-3-5-9/h12H,2-8,10H2,1H3.
What are the key properties of 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol?
1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 172.27 g/mol, XLogP of 0.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-aminoethyl(methyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65213032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).