2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol

C17H34N2O — CID 107228969

IUPAC2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol
SMILESCCCNC1CCCCC1CN1CCCC(CCO)C1
InChIInChI=1S/C17H34N2O/c1-2-10-18-17-8-4-3-7-16(17)14-19-11-5-6-15(13-19)9-12-20/h15-18,20H,2-14H2,1H3
InChIKeyDHSRCHSPAWAOCM-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.64
Rot. Bonds7

About 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol

2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol (PubChem CID 107228969) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol
PubChem CID107228969
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol
SMILESCCCNC1CCCCC1CN1CCCC(CCO)C1
InChIInChI=1S/C17H34N2O/c1-2-10-18-17-8-4-3-7-16(17)14-19-11-5-6-15(13-19)9-12-20/h15-18,20H,2-14H2,1H3
InChIKeyDHSRCHSPAWAOCM-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-N-propylcyclohexan-1-amine
CID 79945526
N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine
CID 55160102
2-[(2-methyl-1,4-oxazepan-4-yl)methyl]-N-propylcyclopentan-1-amine
CID 62973885
N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine
CID 63169213
N-propyl-2-[(4-propylpiperazin-1-yl)methyl]cyclopentan-1-amine
CID 55094030
2-[(2-methyl-1,4-oxazepan-4-yl)methyl]-N-propylcycloheptan-1-amine
CID 62973181
2-[1-[[2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]oxyethanol
CID 82690868
2-[(2-methylmorpholin-4-yl)methyl]-N-propylcyclopentan-1-amine
CID 55093836
2-(1-propylpiperidin-3-yl)ethanol
CID 22987971
4-methyl-1-[[2-(propylamino)cyclohexyl]methyl]azepan-4-ol
CID 107408771
2-[(4-cyclopropylpiperazin-1-yl)methyl]-N-propylcyclohexan-1-amine
CID 62614441
2-(1,4-oxazepan-4-ylmethyl)-N-propylcycloheptan-1-amine
CID 55139983

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol?
The IUPAC name of 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol (CID 107228969) is 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol?
The canonical SMILES for 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol is CCCNC1CCCCC1CN1CCCC(CCO)C1.
What is the InChIKey of 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol?
The InChIKey is DHSRCHSPAWAOCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-2-10-18-17-8-4-3-7-16(17)14-19-11-5-6-15(13-19)9-12-20/h15-18,20H,2-14H2,1H3.
What are the key properties of 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol?
2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol has a molecular weight of 282.47 g/mol, XLogP of 2.64, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol is sourced from PubChem (CID 107228969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).