1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol

C15H32N2O — CID 113497532

IUPAC1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol
SMILESCCCN1CCC(C(C)NCCC(O)CC)CC1
InChIInChI=1S/C15H32N2O/c1-4-10-17-11-7-14(8-12-17)13(3)16-9-6-15(18)5-2/h13-16,18H,4-12H2,1-3H3
InChIKeyDHZLLVXBERTEPK-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.25
Rot. Bonds8

About 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol

1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol (PubChem CID 113497532) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol.

Molecular Properties

Compound Name1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol
PubChem CID113497532
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol
SMILESCCCN1CCC(C(C)NCCC(O)CC)CC1
InChIInChI=1S/C15H32N2O/c1-4-10-17-11-7-14(8-12-17)13(3)16-9-6-15(18)5-2/h13-16,18H,4-12H2,1-3H3
InChIKeyDHZLLVXBERTEPK-UHFFFAOYSA-N
XLogP2.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1-propylpiperidin-4-yl)ethyl]octan-1-amine
CID 115566698
7-methyl-N-[1-(1-propylpiperidin-4-yl)ethyl]octan-1-amine
CID 43308547
3-ethyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol
CID 106284532
3-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]butan-2-ol
CID 113492078
4-[1-(1-ethylpiperidin-4-yl)ethylamino]butan-2-ol
CID 64913210
N'-[1-(1-propylpiperidin-4-yl)ethyl]butane-1,4-diamine
CID 60893438
N'-ethyl-N'-methyl-N-[1-(1-propylpiperidin-4-yl)ethyl]ethane-1,2-diamine
CID 62635023
2-ethyl-2-[[1-(1-propylpiperidin-4-yl)ethylamino]methyl]butan-1-ol
CID 106250980
N-[1-(1-propylpiperidin-4-yl)ethyl]pent-3-yn-1-amine
CID 116642856
N-[1-(1-butylpiperidin-4-yl)ethyl]propan-1-amine
CID 63855012
1-cyclopropyl-N-[2-(4-propan-2-ylpiperidin-1-yl)ethyl]ethanamine
CID 103503465
N',N'-diethyl-N-[1-(1-propylpiperidin-4-yl)ethyl]propane-1,3-diamine
CID 43307897

Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol?
The IUPAC name of 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol (CID 113497532) is 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol.
What is the SMILES notation for 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol?
The canonical SMILES for 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol is CCCN1CCC(C(C)NCCC(O)CC)CC1.
What is the InChIKey of 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol?
The InChIKey is DHZLLVXBERTEPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-4-10-17-11-7-14(8-12-17)13(3)16-9-6-15(18)5-2/h13-16,18H,4-12H2,1-3H3.
What are the key properties of 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol?
1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol has a molecular weight of 256.43 g/mol, XLogP of 2.25, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol is sourced from PubChem (CID 113497532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).