ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine

C12H22N2 — CID 143815645

IUPACethane;3-ethyl-N,N,4-trimethylpyridin-2-amine
SMILESCC.CCc1c(C)ccnc1N(C)C
InChIInChI=1S/C10H16N2.C2H6/c1-5-9-8(2)6-7-11-10(9)12(3)4;1-2/h6-7H,5H2,1-4H3;1-2H3
InChIKeyNRHREOGRAKAJKC-UHFFFAOYSA-N
MW194.32 g/mol
LogP3.04
Rot. Bonds2

About ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine

ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine (PubChem CID 143815645) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine.

Molecular Properties

Compound Nameethane;3-ethyl-N,N,4-trimethylpyridin-2-amine
PubChem CID143815645
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Nameethane;3-ethyl-N,N,4-trimethylpyridin-2-amine
SMILESCC.CCc1c(C)ccnc1N(C)C
InChIInChI=1S/C10H16N2.C2H6/c1-5-9-8(2)6-7-11-10(9)12(3)4;1-2/h6-7H,5H2,1-4H3;1-2H3
InChIKeyNRHREOGRAKAJKC-UHFFFAOYSA-N
XLogP3.04
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine?
The IUPAC name of ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine (CID 143815645) is ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine.
What is the SMILES notation for ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine?
The canonical SMILES for ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine is CC.CCc1c(C)ccnc1N(C)C.
What is the InChIKey of ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine?
The InChIKey is NRHREOGRAKAJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2.C2H6/c1-5-9-8(2)6-7-11-10(9)12(3)4;1-2/h6-7H,5H2,1-4H3;1-2H3.
What are the key properties of ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine?
ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine has a molecular weight of 194.32 g/mol, XLogP of 3.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethyl-N,N,4-trimethylpyridin-2-amine is sourced from PubChem (CID 143815645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).