N,1-diethylpyrrolidin-3-amine

C8H18N2 — CID 14153712

IUPACN,1-diethylpyrrolidin-3-amine
SMILESCCNC1CCN(CC)C1
InChIInChI=1S/C8H18N2/c1-3-9-8-5-6-10(4-2)7-8/h8-9H,3-7H2,1-2H3
InChIKeyYNDDQVCZRACCTJ-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.69
Rot. Bonds3

About N,1-diethylpyrrolidin-3-amine

N,1-diethylpyrrolidin-3-amine (PubChem CID 14153712) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is N,1-diethylpyrrolidin-3-amine.

Molecular Properties

Compound NameN,1-diethylpyrrolidin-3-amine
PubChem CID14153712
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC NameN,1-diethylpyrrolidin-3-amine
SMILESCCNC1CCN(CC)C1
InChIInChI=1S/C8H18N2/c1-3-9-8-5-6-10(4-2)7-8/h8-9H,3-7H2,1-2H3
InChIKeyYNDDQVCZRACCTJ-UHFFFAOYSA-N
XLogP0.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,1-diethylpyrrolidin-3-amine?
The IUPAC name of N,1-diethylpyrrolidin-3-amine (CID 14153712) is N,1-diethylpyrrolidin-3-amine.
What is the SMILES notation for N,1-diethylpyrrolidin-3-amine?
The canonical SMILES for N,1-diethylpyrrolidin-3-amine is CCNC1CCN(CC)C1.
What is the InChIKey of N,1-diethylpyrrolidin-3-amine?
The InChIKey is YNDDQVCZRACCTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-3-9-8-5-6-10(4-2)7-8/h8-9H,3-7H2,1-2H3.
What are the key properties of N,1-diethylpyrrolidin-3-amine?
N,1-diethylpyrrolidin-3-amine has a molecular weight of 142.25 g/mol, XLogP of 0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-diethylpyrrolidin-3-amine is sourced from PubChem (CID 14153712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).