3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol

C14H28N2O — CID 83996265

IUPAC3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol
SMILESCCN1CC(CCCO)CC(NCC2CC2)C1
InChIInChI=1S/C14H28N2O/c1-2-16-10-13(4-3-7-17)8-14(11-16)15-9-12-5-6-12/h12-15,17H,2-11H2,1H3
InChIKeyISCPUKSJNDHWHD-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.47
Rot. Bonds7

About 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol

3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol (PubChem CID 83996265) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol.

Molecular Properties

Compound Name3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol
PubChem CID83996265
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol
SMILESCCN1CC(CCCO)CC(NCC2CC2)C1
InChIInChI=1S/C14H28N2O/c1-2-16-10-13(4-3-7-17)8-14(11-16)15-9-12-5-6-12/h12-15,17H,2-11H2,1H3
InChIKeyISCPUKSJNDHWHD-UHFFFAOYSA-N
XLogP1.47
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol
CID 83996295
3-[1-ethyl-5-(ethylamino)piperidin-3-yl]propan-1-ol
CID 83990202
3-[1-cyclobutyl-5-(cyclopropylmethylamino)piperidin-3-yl]propan-1-ol
CID 83996650
N,5-bis(cyclopropylmethyl)-1-ethylpiperidin-3-amine
CID 83996251
N-(cyclohexylmethyl)-1-ethyl-5-propylpiperidin-3-amine
CID 83998322
2-[3-(cyclopentylmethylamino)-5-(3-hydroxypropyl)piperidin-1-yl]acetamide
CID 83998219
2-[3-(cyclopropylmethylamino)-5-ethylpiperidin-1-yl]ethanol
CID 83996841
3-[5-(cyclobutylmethylamino)-1-ethylpiperidin-3-yl]propanoic acid
CID 83996953
3-[5-(cyclohexylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]propan-1-ol
CID 83998736
N-(cyclohexylmethyl)-5-(cyclopropylmethyl)-1-ethylpiperidin-3-amine
CID 83998325
N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine
CID 83996677
3-[1-(cyclopropylmethyl)-5-(3-methylbutylamino)piperidin-3-yl]propan-1-ol
CID 83995997

Frequently Asked Questions

What is the IUPAC name of 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol?
The IUPAC name of 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol (CID 83996265) is 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol.
What is the SMILES notation for 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol?
The canonical SMILES for 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol is CCN1CC(CCCO)CC(NCC2CC2)C1.
What is the InChIKey of 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol?
The InChIKey is ISCPUKSJNDHWHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-2-16-10-13(4-3-7-17)8-14(11-16)15-9-12-5-6-12/h12-15,17H,2-11H2,1H3.
What are the key properties of 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol?
3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.47, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol is sourced from PubChem (CID 83996265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).