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

C18H34N2O — CID 83997394

IUPAC3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol
SMILESCC(C1CC1)N1CC(CCCO)CC(NCC2CCC2)C1
InChIInChI=1S/C18H34N2O/c1-14(17-7-8-17)20-12-16(6-3-9-21)10-18(13-20)19-11-15-4-2-5-15/h14-19,21H,2-13H2,1H3
InChIKeyWEILKIUQAAVNPD-UHFFFAOYSA-N
MW294.48 g/mol
LogP2.64
Rot. Bonds8

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

3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol (PubChem CID 83997394) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol.

Molecular Properties

Compound Name3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol
PubChem CID83997394
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol
SMILESCC(C1CC1)N1CC(CCCO)CC(NCC2CCC2)C1
InChIInChI=1S/C18H34N2O/c1-14(17-7-8-17)20-12-16(6-3-9-21)10-18(13-20)19-11-15-4-2-5-15/h14-19,21H,2-13H2,1H3
InChIKeyWEILKIUQAAVNPD-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-(1-cyclopropylethyl)-5-(ethylamino)piperidin-3-yl]propan-1-ol
CID 83990589
2-[5-(cyclohexylmethylamino)-1-propan-2-ylpiperidin-3-yl]ethanol
CID 83998440
2-[1-(1-cyclobutylethyl)-5-(2,2-dimethylpropylamino)piperidin-3-yl]ethanol
CID 83995340
5-butyl-1-(1-cyclopropylethyl)-N-ethylpiperidin-3-amine
CID 83990582
3-[5-(cyclohexylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]propan-1-ol
CID 83998736
3-[1-cyclobutyl-5-(cyclopropylmethylamino)piperidin-3-yl]propan-1-ol
CID 83996650
3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol
CID 83996265
2-[3-(cyclopentylmethylamino)-5-(3-hydroxypropyl)piperidin-1-yl]acetamide
CID 83998219
N-(cyclobutylmethyl)-5-ethyl-1-propan-2-ylpiperidin-3-amine
CID 83997047
3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol
CID 83996295
N-(cyclopentylmethyl)-1-(1-cyclopropylpropyl)-5-propylpiperidin-3-amine
CID 83998092
1-[5-(cyclobutylmethylamino)-1-propan-2-ylpiperidin-3-yl]-3-methylbutan-2-ol
CID 83997066

Frequently Asked Questions

What is the IUPAC name of 3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol?
The IUPAC name of 3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol (CID 83997394) is 3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol.
What is the SMILES notation for 3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol?
The canonical SMILES for 3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol is CC(C1CC1)N1CC(CCCO)CC(NCC2CCC2)C1.
What is the InChIKey of 3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol?
The InChIKey is WEILKIUQAAVNPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-14(17-7-8-17)20-12-16(6-3-9-21)10-18(13-20)19-11-15-4-2-5-15/h14-19,21H,2-13H2,1H3.
What are the key properties of 3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol?
3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol has a molecular weight of 294.48 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 3-[5-(cyclobutylmethylamino)-1-(1-cyclopropylethyl)piperidin-3-yl]propan-1-ol is sourced from PubChem (CID 83997394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).