3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol

C15H30N2O — CID 83990589

IUPAC3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol
SMILESCCNC1CC(CCCO)CN(C(C)C2CC2)C1
InChIInChI=1S/C15H30N2O/c1-3-16-15-9-13(5-4-8-18)10-17(11-15)12(2)14-6-7-14/h12-16,18H,3-11H2,1-2H3
InChIKeyKZNYPBXISBNYII-UHFFFAOYSA-N
MW254.42 g/mol
LogP1.86
Rot. Bonds7

About 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol

3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol (PubChem CID 83990589) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol.

Molecular Properties

Compound Name3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol
PubChem CID83990589
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol
SMILESCCNC1CC(CCCO)CN(C(C)C2CC2)C1
InChIInChI=1S/C15H30N2O/c1-3-16-15-9-13(5-4-8-18)10-17(11-15)12(2)14-6-7-14/h12-16,18H,3-11H2,1-2H3
InChIKeyKZNYPBXISBNYII-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-butyl-1-(1-cyclopropylethyl)-N-ethylpiperidin-3-amine
CID 83990582
3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol
CID 83997394
3-[1-ethyl-5-(ethylamino)piperidin-3-yl]propan-1-ol
CID 83990202
2-[1-(1-cyclobutylethyl)-5-(2,2-dimethylpropylamino)piperidin-3-yl]ethanol
CID 83995340
N-benzyl-5-butyl-1-(1-cyclopropylethyl)piperidin-3-amine
CID 83993929
3-[1-butan-2-yl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]propan-1-ol
CID 83992434
N-[1-(1-cyclopropylethyl)-5-propylpiperidin-3-yl]-2,2-dimethylpropanamide
CID 112542431
N-[5-(3-hydroxypropyl)-1-propan-2-ylpiperidin-3-yl]acetamide
CID 112541751
1-(1-cyclopropylethyl)-5-(cyclopropylmethyl)-N-(3-methylbutyl)piperidin-3-amine
CID 83996007
5-(cyclopropylmethyl)-N-ethyl-1-propan-2-ylpiperidin-3-amine
CID 83990284
3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol
CID 83996265
3-[1-(cyclopropylmethyl)-5-(3-methylbutylamino)piperidin-3-yl]propan-1-ol
CID 83995997

Frequently Asked Questions

What is the IUPAC name of 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol?
The IUPAC name of 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol (CID 83990589) is 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol.
What is the SMILES notation for 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol?
The canonical SMILES for 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol is CCNC1CC(CCCO)CN(C(C)C2CC2)C1.
What is the InChIKey of 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol?
The InChIKey is KZNYPBXISBNYII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-16-15-9-13(5-4-8-18)10-17(11-15)12(2)14-6-7-14/h12-16,18H,3-11H2,1-2H3.
What are the key properties of 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol?
3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol has a molecular weight of 254.42 g/mol, XLogP of 1.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol is sourced from PubChem (CID 83990589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).