5-(2-aminocyclopentyl)pentane-1,4-diol

C10H21NO2 — CID 13025945

IUPAC5-(2-aminocyclopentyl)pentane-1,4-diol
SMILESNC1CCCC1CC(O)CCCO
InChIInChI=1S/C10H21NO2/c11-10-5-1-3-8(10)7-9(13)4-2-6-12/h8-10,12-13H,1-7,11H2
InChIKeyHQDSRRHYUQVMTN-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.64
Rot. Bonds5

About 5-(2-aminocyclopentyl)pentane-1,4-diol

5-(2-aminocyclopentyl)pentane-1,4-diol (PubChem CID 13025945) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 5-(2-aminocyclopentyl)pentane-1,4-diol.

Molecular Properties

Compound Name5-(2-aminocyclopentyl)pentane-1,4-diol
PubChem CID13025945
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name5-(2-aminocyclopentyl)pentane-1,4-diol
SMILESNC1CCCC1CC(O)CCCO
InChIInChI=1S/C10H21NO2/c11-10-5-1-3-8(10)7-9(13)4-2-6-12/h8-10,12-13H,1-7,11H2
InChIKeyHQDSRRHYUQVMTN-UHFFFAOYSA-N
XLogP0.64
TPSA66.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminocyclopentyl)pentane-1,4-diol?
The IUPAC name of 5-(2-aminocyclopentyl)pentane-1,4-diol (CID 13025945) is 5-(2-aminocyclopentyl)pentane-1,4-diol.
What is the SMILES notation for 5-(2-aminocyclopentyl)pentane-1,4-diol?
The canonical SMILES for 5-(2-aminocyclopentyl)pentane-1,4-diol is NC1CCCC1CC(O)CCCO.
What is the InChIKey of 5-(2-aminocyclopentyl)pentane-1,4-diol?
The InChIKey is HQDSRRHYUQVMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c11-10-5-1-3-8(10)7-9(13)4-2-6-12/h8-10,12-13H,1-7,11H2.
What are the key properties of 5-(2-aminocyclopentyl)pentane-1,4-diol?
5-(2-aminocyclopentyl)pentane-1,4-diol has a molecular weight of 187.28 g/mol, XLogP of 0.64, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminocyclopentyl)pentane-1,4-diol is sourced from PubChem (CID 13025945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).