1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol

C17H34N2O — CID 62608959

IUPAC1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol
SMILESCCCC1CCC(NCC)C(CN2CCCC(O)C2)C1
InChIInChI=1S/C17H34N2O/c1-3-6-14-8-9-17(18-4-2)15(11-14)12-19-10-5-7-16(20)13-19/h14-18,20H,3-13H2,1-2H3
InChIKeySQBZHEZPFQNKKE-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.64
Rot. Bonds6

About 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol

1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol (PubChem CID 62608959) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol
PubChem CID62608959
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol
SMILESCCCC1CCC(NCC)C(CN2CCCC(O)C2)C1
InChIInChI=1S/C17H34N2O/c1-3-6-14-8-9-17(18-4-2)15(11-14)12-19-10-5-7-16(20)13-19/h14-18,20H,3-13H2,1-2H3
InChIKeySQBZHEZPFQNKKE-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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

N-ethyl-4-propyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine
CID 62616394
1-[[5-propyl-2-(propylamino)cyclohexyl]methyl]piperidin-4-ol
CID 62614801
N-ethyl-2-[(2-ethylpyrrolidin-1-yl)methyl]-4-propylcyclohexan-1-amine
CID 63482113
1-[[2-(ethylamino)cycloheptyl]methyl]pyrrolidin-3-ol
CID 62941371
2-(azepan-1-ylmethyl)-N-methyl-4-propylcyclohexan-1-amine
CID 62616400
4-propyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-ol
CID 62611262
2-(cyclopentylmethyl)-N-ethyl-4-propylcyclohexan-1-amine
CID 63401306
2-(azepan-1-ylmethyl)-N-ethyl-4-methylcyclohexan-1-amine
CID 62616066
N,4-diethyl-2-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-amine
CID 63636012
N,4-diethyl-2-(1,4-thiazepan-4-ylmethyl)cyclohexan-1-amine
CID 55094286
2-[4-[[5-ethyl-2-(ethylamino)cyclohexyl]methyl]piperazin-1-yl]ethanol
CID 62614447
N-ethyl-2-(2-ethylsulfanylethyl)-4-propylcyclohexan-1-amine
CID 113473890

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol?
The IUPAC name of 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol (CID 62608959) is 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol.
What is the SMILES notation for 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol?
The canonical SMILES for 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol is CCCC1CCC(NCC)C(CN2CCCC(O)C2)C1.
What is the InChIKey of 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol?
The InChIKey is SQBZHEZPFQNKKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-3-6-14-8-9-17(18-4-2)15(11-14)12-19-10-5-7-16(20)13-19/h14-18,20H,3-13H2,1-2H3.
What are the key properties of 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol?
1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol has a molecular weight of 282.47 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(ethylamino)-5-propylcyclohexyl]methyl]piperidin-3-ol is sourced from PubChem (CID 62608959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).