2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol

C16H32N2O2 — CID 82690868

IUPAC2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol
SMILESCCCNC1CCCC1CN1CCC(OCCO)CC1
InChIInChI=1S/C16H32N2O2/c1-2-8-17-16-5-3-4-14(16)13-18-9-6-15(7-10-18)20-12-11-19/h14-17,19H,2-13H2,1H3
InChIKeyJXYSIQOTFVNKFE-UHFFFAOYSA-N
MW284.44 g/mol
LogP1.63
Rot. Bonds8

About 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol

2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol (PubChem CID 82690868) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol.

Molecular Properties

Compound Name2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol
PubChem CID82690868
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol
SMILESCCCNC1CCCC1CN1CCC(OCCO)CC1
InChIInChI=1S/C16H32N2O2/c1-2-8-17-16-5-3-4-14(16)13-18-9-6-15(7-10-18)20-12-11-19/h14-17,19H,2-13H2,1H3
InChIKeyJXYSIQOTFVNKFE-UHFFFAOYSA-N
XLogP1.63
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-2-[(4-propylpiperazin-1-yl)methyl]cyclopentan-1-amine
CID 55094030
2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol
CID 107228969
2-[(4-propan-2-ylpiperazin-1-yl)methyl]-N-propylcyclopentan-1-amine
CID 62616468
2-[[4-(methoxymethyl)piperidin-1-yl]methyl]-N-propylcycloheptan-1-amine
CID 63973579
2-[(4-cyclopropylpiperazin-1-yl)methyl]-N-propylcyclohexan-1-amine
CID 62614441
2-[2-(4-methylcyclohexyl)oxyethyl]-N-propylcyclopentan-1-amine
CID 79572685
N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine
CID 63169213
2-[(4-propan-2-ylpiperazin-1-yl)methyl]-N-propylcyclohexan-1-amine
CID 62616357
2-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]-N-propylcyclohexan-1-amine
CID 62616535
2-[4-[[2-(ethylamino)cyclopentyl]methyl]piperazin-1-yl]ethanol
CID 62616915
N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine
CID 55160102
4-methyl-1-[[2-(propylamino)cyclohexyl]methyl]azepan-4-ol
CID 107408771

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol?
The IUPAC name of 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol (CID 82690868) is 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol.
What is the SMILES notation for 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol?
The canonical SMILES for 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol is CCCNC1CCCC1CN1CCC(OCCO)CC1.
What is the InChIKey of 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol?
The InChIKey is JXYSIQOTFVNKFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-2-8-17-16-5-3-4-14(16)13-18-9-6-15(7-10-18)20-12-11-19/h14-17,19H,2-13H2,1H3.
What are the key properties of 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol?
2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol has a molecular weight of 284.44 g/mol, XLogP of 1.63, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol is sourced from PubChem (CID 82690868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).