1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol

C16H26N2O2 — CID 82738008

IUPAC1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol
SMILESCCc1cccnc1CNCC(O)COC1CCCC1
InChIInChI=1S/C16H26N2O2/c1-2-13-6-5-9-18-16(13)11-17-10-14(19)12-20-15-7-3-4-8-15/h5-6,9,14-15,17,19H,2-4,7-8,10-12H2,1H3
InChIKeyNXSJAZFFTZKZNB-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.05
Rot. Bonds8

About 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol

1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol (PubChem CID 82738008) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol
PubChem CID82738008
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol
SMILESCCc1cccnc1CNCC(O)COC1CCCC1
InChIInChI=1S/C16H26N2O2/c1-2-13-6-5-9-18-16(13)11-17-10-14(19)12-20-15-7-3-4-8-15/h5-6,9,14-15,17,19H,2-4,7-8,10-12H2,1H3
InChIKeyNXSJAZFFTZKZNB-UHFFFAOYSA-N
XLogP2.05
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(3-cyclohexyloxy-2-hydroxypropyl)amino]methyl]phenol
CID 114331934
1-[(3-ethyl-2-pyridinyl)methylamino]-3-pyrrolidin-1-ylpropan-2-ol
CID 82734995
1-cyclopentyloxy-3-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]propan-2-ol
CID 115989616
1-cyclopentyloxy-3-[2-(2-methylphenyl)ethylamino]propan-2-ol
CID 79748980
1-cyclopentyloxy-3-[(3-methylphenyl)methylamino]propan-2-ol
CID 60729329
1-(4-tert-butylcyclohexyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 104575269
2-[(3-ethyl-2-pyridinyl)methylamino]-1-thiophen-2-ylethanol
CID 82738388
1-cyclopentyloxy-3-(2-phenylpropylamino)propan-2-ol
CID 104591392
2-[(3-ethyl-2-pyridinyl)methylamino]ethanol
CID 82738095
1-cyclopentyloxy-3-[(2-methyl-1,3-thiazol-4-yl)methylamino]propan-2-ol
CID 61280895
1-(azepan-1-yl)-2-[(3-ethyl-2-pyridinyl)methylamino]ethanone
CID 82738475
N-[(3-ethyl-2-pyridinyl)methyl]-1-(oxolan-3-yl)methanamine
CID 82733178

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol?
The IUPAC name of 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol (CID 82738008) is 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol.
What is the SMILES notation for 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol?
The canonical SMILES for 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol is CCc1cccnc1CNCC(O)COC1CCCC1.
What is the InChIKey of 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol?
The InChIKey is NXSJAZFFTZKZNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-2-13-6-5-9-18-16(13)11-17-10-14(19)12-20-15-7-3-4-8-15/h5-6,9,14-15,17,19H,2-4,7-8,10-12H2,1H3.
What are the key properties of 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol?
1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol has a molecular weight of 278.40 g/mol, XLogP of 2.05, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyloxy-3-[(3-ethyl-2-pyridinyl)methylamino]propan-2-ol is sourced from PubChem (CID 82738008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).