4-amino-1-ethylpiperidine-4-carbonitrile

C8H15N3 — CID 16792694

IUPAC4-amino-1-ethylpiperidine-4-carbonitrile
SMILESCCN1CCC(N)(C#N)CC1
InChIInChI=1S/C8H15N3/c1-2-11-5-3-8(10,7-9)4-6-11/h2-6,10H2,1H3
InChIKeyOSKHEBDRYLYZPN-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.32
Rot. Bonds1

About 4-amino-1-ethylpiperidine-4-carbonitrile

4-amino-1-ethylpiperidine-4-carbonitrile (PubChem CID 16792694) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 4-amino-1-ethylpiperidine-4-carbonitrile.

Molecular Properties

Compound Name4-amino-1-ethylpiperidine-4-carbonitrile
PubChem CID16792694
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name4-amino-1-ethylpiperidine-4-carbonitrile
SMILESCCN1CCC(N)(C#N)CC1
InChIInChI=1S/C8H15N3/c1-2-11-5-3-8(10,7-9)4-6-11/h2-6,10H2,1H3
InChIKeyOSKHEBDRYLYZPN-UHFFFAOYSA-N
XLogP0.32
TPSA53.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethylpiperidine-4-carbonitrile?
The IUPAC name of 4-amino-1-ethylpiperidine-4-carbonitrile (CID 16792694) is 4-amino-1-ethylpiperidine-4-carbonitrile.
What is the SMILES notation for 4-amino-1-ethylpiperidine-4-carbonitrile?
The canonical SMILES for 4-amino-1-ethylpiperidine-4-carbonitrile is CCN1CCC(N)(C#N)CC1.
What is the InChIKey of 4-amino-1-ethylpiperidine-4-carbonitrile?
The InChIKey is OSKHEBDRYLYZPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-2-11-5-3-8(10,7-9)4-6-11/h2-6,10H2,1H3.
What are the key properties of 4-amino-1-ethylpiperidine-4-carbonitrile?
4-amino-1-ethylpiperidine-4-carbonitrile has a molecular weight of 153.23 g/mol, XLogP of 0.32, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethylpiperidine-4-carbonitrile is sourced from PubChem (CID 16792694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).