3-(1-cyclopentylethylamino)propane-1,2-diol

C10H21NO2 — CID 66177375

IUPAC3-(1-cyclopentylethylamino)propane-1,2-diol
SMILESCC(NCC(O)CO)C1CCCC1
InChIInChI=1S/C10H21NO2/c1-8(9-4-2-3-5-9)11-6-10(13)7-12/h8-13H,2-7H2,1H3
InChIKeyJYQIPJDHNVPCCV-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.51
Rot. Bonds5

About 3-(1-cyclopentylethylamino)propane-1,2-diol

3-(1-cyclopentylethylamino)propane-1,2-diol (PubChem CID 66177375) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 3-(1-cyclopentylethylamino)propane-1,2-diol.

Molecular Properties

Compound Name3-(1-cyclopentylethylamino)propane-1,2-diol
PubChem CID66177375
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name3-(1-cyclopentylethylamino)propane-1,2-diol
SMILESCC(NCC(O)CO)C1CCCC1
InChIInChI=1S/C10H21NO2/c1-8(9-4-2-3-5-9)11-6-10(13)7-12/h8-13H,2-7H2,1H3
InChIKeyJYQIPJDHNVPCCV-UHFFFAOYSA-N
XLogP0.51
TPSA52.49 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 ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-3-(1-cyclopentylethylamino)propan-2-ol
CID 103157832
(2R)-1-[[(1S)-1-cyclopentylethyl]amino]propan-2-ol
CID 94524291
1-(1-cyclopentylethylamino)pentan-2-ol
CID 115719405
3-[1-(1-methylpiperidin-3-yl)ethylamino]propane-1,2-diol
CID 66176759
1-[[(1R)-1-cyclohexylethyl]amino]-3-propan-2-yloxypropan-2-ol
CID 81385135
1-[[(1S)-1-cycloheptylethyl]amino]-3-(dimethylamino)propan-2-ol
CID 81393172
1-[[(1R)-1-cyclopentylethyl]amino]-3-pyrrolidin-1-ylpropan-2-ol
CID 81396165
N-[(1R)-1-cyclopentylethyl]-2-methylpropan-1-amine
CID 81394382
3-(1-cyclohexylpropylamino)propane-1,2-diol
CID 76943229
1-[[(1S)-1-cycloheptylethyl]amino]-3-cyclopentyloxypropan-2-ol
CID 81391866
5-(1-cyclohexylethylamino)-4-methylpentan-2-ol
CID 111755682
1-[[(1R)-1-cyclopentylethyl]amino]-3-(4-methylpentan-2-yloxy)propan-2-ol
CID 81396507

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopentylethylamino)propane-1,2-diol?
The IUPAC name of 3-(1-cyclopentylethylamino)propane-1,2-diol (CID 66177375) is 3-(1-cyclopentylethylamino)propane-1,2-diol.
What is the SMILES notation for 3-(1-cyclopentylethylamino)propane-1,2-diol?
The canonical SMILES for 3-(1-cyclopentylethylamino)propane-1,2-diol is CC(NCC(O)CO)C1CCCC1.
What is the InChIKey of 3-(1-cyclopentylethylamino)propane-1,2-diol?
The InChIKey is JYQIPJDHNVPCCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-8(9-4-2-3-5-9)11-6-10(13)7-12/h8-13H,2-7H2,1H3.
What are the key properties of 3-(1-cyclopentylethylamino)propane-1,2-diol?
3-(1-cyclopentylethylamino)propane-1,2-diol has a molecular weight of 187.28 g/mol, XLogP of 0.51, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopentylethylamino)propane-1,2-diol is sourced from PubChem (CID 66177375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).