1,2,2-triethylpyrrolidin-3-amine

C10H22N2 — CID 25131250

IUPAC1,2,2-triethylpyrrolidin-3-amine
SMILESCCN1CCC(N)C1(CC)CC
InChIInChI=1S/C10H22N2/c1-4-10(5-2)9(11)7-8-12(10)6-3/h9H,4-8,11H2,1-3H3
InChIKeySXISMNVLYDBYCP-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.60
Rot. Bonds3

About 1,2,2-triethylpyrrolidin-3-amine

1,2,2-triethylpyrrolidin-3-amine (PubChem CID 25131250) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1,2,2-triethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1,2,2-triethylpyrrolidin-3-amine
PubChem CID25131250
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1,2,2-triethylpyrrolidin-3-amine
SMILESCCN1CCC(N)C1(CC)CC
InChIInChI=1S/C10H22N2/c1-4-10(5-2)9(11)7-8-12(10)6-3/h9H,4-8,11H2,1-3H3
InChIKeySXISMNVLYDBYCP-UHFFFAOYSA-N
XLogP1.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2,2-triethylpyrrolidin-3-amine?
The IUPAC name of 1,2,2-triethylpyrrolidin-3-amine (CID 25131250) is 1,2,2-triethylpyrrolidin-3-amine.
What is the SMILES notation for 1,2,2-triethylpyrrolidin-3-amine?
The canonical SMILES for 1,2,2-triethylpyrrolidin-3-amine is CCN1CCC(N)C1(CC)CC.
What is the InChIKey of 1,2,2-triethylpyrrolidin-3-amine?
The InChIKey is SXISMNVLYDBYCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-4-10(5-2)9(11)7-8-12(10)6-3/h9H,4-8,11H2,1-3H3.
What are the key properties of 1,2,2-triethylpyrrolidin-3-amine?
1,2,2-triethylpyrrolidin-3-amine has a molecular weight of 170.30 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2-triethylpyrrolidin-3-amine is sourced from PubChem (CID 25131250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).