1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol

C11H23NO2 — CID 103157277

IUPAC1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol
SMILESOCCCNCC(O)CC1CCCC1
InChIInChI=1S/C11H23NO2/c13-7-3-6-12-9-11(14)8-10-4-1-2-5-10/h10-14H,1-9H2
InChIKeyAQMDGDIBTUQDEJ-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.90
Rot. Bonds7

About 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol

1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol (PubChem CID 103157277) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol
PubChem CID103157277
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol
SMILESOCCCNCC(O)CC1CCCC1
InChIInChI=1S/C11H23NO2/c13-7-3-6-12-9-11(14)8-10-4-1-2-5-10/h10-14H,1-9H2
InChIKeyAQMDGDIBTUQDEJ-UHFFFAOYSA-N
XLogP0.90
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-cyclopentyl-3-[3-(dimethylamino)propylamino]propan-2-ol
CID 103157144
1-(but-3-enylamino)-3-cyclopentylpropan-2-ol
CID 103158305
1-cyclopentyl-3-(2-propan-2-yloxyethylamino)propan-2-ol
CID 103158287
1-cyclopentyl-3-[4-[methyl(propan-2-yl)amino]butylamino]propan-2-ol
CID 103157622
1-(2-butoxyethylamino)-3-cyclopentylpropan-2-ol
CID 103157414
1-cyclopentyl-3-(2-piperidin-1-ylethylamino)propan-2-ol
CID 103157548
3-(cyclooctylmethylamino)propan-1-ol
CID 115674336
1-cyclopentyl-3-(2,2,2-trifluoroethylamino)propan-2-ol
CID 103157182
3-[[(3-cyclopentyl-2-hydroxypropyl)amino]methyl]cyclobutan-1-ol
CID 103157965
1-cyclopentyl-3-hydrazinylpropan-2-ol
CID 103156923
1-cyclopentyl-3-(4-imidazol-1-ylbutylamino)propan-2-ol
CID 103157604
3-(2-cycloheptylethylamino)propan-1-ol
CID 114457835

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol?
The IUPAC name of 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol (CID 103157277) is 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol is OCCCNCC(O)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol?
The InChIKey is AQMDGDIBTUQDEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c13-7-3-6-12-9-11(14)8-10-4-1-2-5-10/h10-14H,1-9H2.
What are the key properties of 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol?
1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol has a molecular weight of 201.31 g/mol, XLogP of 0.90, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol is sourced from PubChem (CID 103157277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).