2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine

C16H26N2 — CID 105014663

IUPAC2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
SMILESCCc1ccc(CC(N)C2C(C)(C)C2(C)C)nc1
InChIInChI=1S/C16H26N2/c1-6-11-7-8-12(18-10-11)9-13(17)14-15(2,3)16(14,4)5/h7-8,10,13-14H,6,9,17H2,1-5H3
InChIKeyDRNVCGWKRQONQV-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.20
Rot. Bonds4

About 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine

2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine (PubChem CID 105014663) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine.

Molecular Properties

Compound Name2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
PubChem CID105014663
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
SMILESCCc1ccc(CC(N)C2C(C)(C)C2(C)C)nc1
InChIInChI=1S/C16H26N2/c1-6-11-7-8-12(18-10-11)9-13(17)14-15(2,3)16(14,4)5/h7-8,10,13-14H,6,9,17H2,1-5H3
InChIKeyDRNVCGWKRQONQV-UHFFFAOYSA-N
XLogP3.20
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
The IUPAC name of 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine (CID 105014663) is 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine.
What is the SMILES notation for 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
The canonical SMILES for 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine is CCc1ccc(CC(N)C2C(C)(C)C2(C)C)nc1.
What is the InChIKey of 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
The InChIKey is DRNVCGWKRQONQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-6-11-7-8-12(18-10-11)9-13(17)14-15(2,3)16(14,4)5/h7-8,10,13-14H,6,9,17H2,1-5H3.
What are the key properties of 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine has a molecular weight of 246.40 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-2-pyridinyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine is sourced from PubChem (CID 105014663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).