4-(3-cyclopentylpropylamino)oxolan-3-ol

C12H23NO2 — CID 106010570

IUPAC4-(3-cyclopentylpropylamino)oxolan-3-ol
SMILESOC1COCC1NCCCC1CCCC1
InChIInChI=1S/C12H23NO2/c14-12-9-15-8-11(12)13-7-3-6-10-4-1-2-5-10/h10-14H,1-9H2
InChIKeyHHHDEZMIWPBKNN-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.31
Rot. Bonds5

About 4-(3-cyclopentylpropylamino)oxolan-3-ol

4-(3-cyclopentylpropylamino)oxolan-3-ol (PubChem CID 106010570) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-(3-cyclopentylpropylamino)oxolan-3-ol.

Molecular Properties

Compound Name4-(3-cyclopentylpropylamino)oxolan-3-ol
PubChem CID106010570
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name4-(3-cyclopentylpropylamino)oxolan-3-ol
SMILESOC1COCC1NCCCC1CCCC1
InChIInChI=1S/C12H23NO2/c14-12-9-15-8-11(12)13-7-3-6-10-4-1-2-5-10/h10-14H,1-9H2
InChIKeyHHHDEZMIWPBKNN-UHFFFAOYSA-N
XLogP1.31
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

trans-(1R,2R)-2-(3-cyclopropylpropylamino)cyclohexan-1-ol
CID 102731748
4-(4-aminobutylamino)oxolan-3-ol
CID 155892283
4-[3-(diethylamino)propylamino]oxolan-3-ol
CID 60896657
2-(3-cyclopentylpropylamino)cyclobutane-1-carboxylic acid
CID 106004248
(3S,4R)-4-(3-propan-2-yloxypropylamino)oxolan-3-ol
CID 126846624
4-[(4-hydroxycyclohexyl)methylamino]oxolan-3-ol
CID 106133383
(3S,4R)-4-(oxan-4-ylmethylamino)oxolan-3-ol
CID 126846605
3-cyclopentyl-N-(oxolan-3-ylmethyl)propan-1-amine
CID 115887250
N-(2-cyclohexylethyl)oxetan-3-amine
CID 63623286
trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol
CID 102734088
4-(3-cyclopropylpropylamino)-1,1-dioxothiolan-3-ol
CID 115638949
6-(3-cyclohexylpropylamino)-5,6,7,8-tetrahydronaphthalene-1,2,5-triol
CID 21451172

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentylpropylamino)oxolan-3-ol?
The IUPAC name of 4-(3-cyclopentylpropylamino)oxolan-3-ol (CID 106010570) is 4-(3-cyclopentylpropylamino)oxolan-3-ol.
What is the SMILES notation for 4-(3-cyclopentylpropylamino)oxolan-3-ol?
The canonical SMILES for 4-(3-cyclopentylpropylamino)oxolan-3-ol is OC1COCC1NCCCC1CCCC1.
What is the InChIKey of 4-(3-cyclopentylpropylamino)oxolan-3-ol?
The InChIKey is HHHDEZMIWPBKNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c14-12-9-15-8-11(12)13-7-3-6-10-4-1-2-5-10/h10-14H,1-9H2.
What are the key properties of 4-(3-cyclopentylpropylamino)oxolan-3-ol?
4-(3-cyclopentylpropylamino)oxolan-3-ol has a molecular weight of 213.32 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentylpropylamino)oxolan-3-ol is sourced from PubChem (CID 106010570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).