2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol

C16H34N2O — CID 106290472

IUPAC2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol
SMILESCCCN1CCC(C(C)NCC(C)(O)CCC)CC1
InChIInChI=1S/C16H34N2O/c1-5-9-16(4,19)13-17-14(3)15-7-11-18(10-6-2)12-8-15/h14-15,17,19H,5-13H2,1-4H3
InChIKeyDLOJCZWOGUEZEJ-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.64
Rot. Bonds8

About 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol

2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol (PubChem CID 106290472) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol.

Molecular Properties

Compound Name2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol
PubChem CID106290472
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol
SMILESCCCN1CCC(C(C)NCC(C)(O)CCC)CC1
InChIInChI=1S/C16H34N2O/c1-5-9-16(4,19)13-17-14(3)15-7-11-18(10-6-2)12-8-15/h14-15,17,19H,5-13H2,1-4H3
InChIKeyDLOJCZWOGUEZEJ-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-2-[[1-(1-propylpiperidin-4-yl)ethylamino]methyl]butan-1-ol
CID 106250980
4-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-2-methylbutan-2-ol
CID 79359785
1-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxy-2-methylbutan-2-ol
CID 106249309
2-methyl-3-[1-(1-methylpiperidin-4-yl)ethylamino]propane-1,2-diol
CID 66169642
3-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]butan-2-ol
CID 113492078
2-[1-(1-propylpiperidin-4-yl)ethylamino]propan-1-ol
CID 43499437
3,3-dimethyl-N-[1-(1-propylpiperidin-4-yl)ethyl]butan-2-amine
CID 113457709
N-[1-(1-propylpiperidin-4-yl)ethyl]octan-1-amine
CID 115566698
1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol
CID 113497532
3-ethyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol
CID 106284532
3-[[1-(1-propylpiperidin-3-yl)ethylamino]methyl]pentan-3-ol
CID 65105569
1-(1-cyclohexylethylamino)-2-methylbutan-2-ol
CID 65108537

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol?
The IUPAC name of 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol (CID 106290472) is 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol.
What is the SMILES notation for 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol?
The canonical SMILES for 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol is CCCN1CCC(C(C)NCC(C)(O)CCC)CC1.
What is the InChIKey of 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol?
The InChIKey is DLOJCZWOGUEZEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-5-9-16(4,19)13-17-14(3)15-7-11-18(10-6-2)12-8-15/h14-15,17,19H,5-13H2,1-4H3.
What are the key properties of 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol?
2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol has a molecular weight of 270.46 g/mol, XLogP of 2.64, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol is sourced from PubChem (CID 106290472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).