4-ethyl-1-prop-2-ynylpiperidine

C10H17N — CID 60965394

IUPAC4-ethyl-1-prop-2-ynylpiperidine
SMILESC#CCN1CCC(CC)CC1
InChIInChI=1S/C10H17N/c1-3-7-11-8-5-10(4-2)6-9-11/h1,10H,4-9H2,2H3
InChIKeyLDKVYKXYQITDJN-UHFFFAOYSA-N
MW151.25 g/mol
LogP1.74
Rot. Bonds2

About 4-ethyl-1-prop-2-ynylpiperidine

4-ethyl-1-prop-2-ynylpiperidine (PubChem CID 60965394) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 4-ethyl-1-prop-2-ynylpiperidine.

Molecular Properties

Compound Name4-ethyl-1-prop-2-ynylpiperidine
PubChem CID60965394
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name4-ethyl-1-prop-2-ynylpiperidine
SMILESC#CCN1CCC(CC)CC1
InChIInChI=1S/C10H17N/c1-3-7-11-8-5-10(4-2)6-9-11/h1,10H,4-9H2,2H3
InChIKeyLDKVYKXYQITDJN-UHFFFAOYSA-N
XLogP1.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

3-propyl-1-prop-2-ynylpyrrolidine
CID 115667587
1,4,7-tris(prop-2-ynyl)-1,4,7-triazonane
CID 90277190
3-(1-prop-2-ynylpiperidin-4-yl)propanenitrile
CID 131003081
1,4-diethylpiperidine;ethane
CID 143709904
1-prop-2-ynylpyrrolidin-3-amine
CID 60861470
1-prop-2-ynylpiperidin-4-ol;hydrochloride
CID 146626948
4-ethylpiperidine-1-carbonitrile
CID 89030426
1-methyl-N-(1-prop-2-ynylpiperidin-4-yl)piperidin-4-amine
CID 43775828
4-piperidin-1-yl-1-prop-2-ynylpiperidine
CID 51086786
1-[(1-prop-2-ynylpiperidin-4-yl)amino]pentan-2-ol
CID 115719377
1-[2-(azetidin-1-yl)ethyl]-4-ethylazocane;ethane
CID 143029154
1,4-diethylazepane
CID 67522864

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-prop-2-ynylpiperidine?
The IUPAC name of 4-ethyl-1-prop-2-ynylpiperidine (CID 60965394) is 4-ethyl-1-prop-2-ynylpiperidine.
What is the SMILES notation for 4-ethyl-1-prop-2-ynylpiperidine?
The canonical SMILES for 4-ethyl-1-prop-2-ynylpiperidine is C#CCN1CCC(CC)CC1.
What is the InChIKey of 4-ethyl-1-prop-2-ynylpiperidine?
The InChIKey is LDKVYKXYQITDJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-3-7-11-8-5-10(4-2)6-9-11/h1,10H,4-9H2,2H3.
What are the key properties of 4-ethyl-1-prop-2-ynylpiperidine?
4-ethyl-1-prop-2-ynylpiperidine has a molecular weight of 151.25 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-prop-2-ynylpiperidine is sourced from PubChem (CID 60965394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).