3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine

C17H30N4 — CID 63211011

IUPAC3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine
SMILESCCNCc1c(C)cc(C)nc1N(C)CCN1CCCC1
InChIInChI=1S/C17H30N4/c1-5-18-13-16-14(2)12-15(3)19-17(16)20(4)10-11-21-8-6-7-9-21/h12,18H,5-11,13H2,1-4H3
InChIKeyCXHCRYQEACGCSS-UHFFFAOYSA-N
MW290.46 g/mol
LogP2.34
Rot. Bonds7

About 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine

3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine (PubChem CID 63211011) has the molecular formula C17H30N4 and a molecular weight of 290.46 g/mol. Its IUPAC name is 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine
PubChem CID63211011
Molecular FormulaC17H30N4
Molecular Weight290.46 g/mol
Exact Mass290.25
IUPAC Name3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine
SMILESCCNCc1c(C)cc(C)nc1N(C)CCN1CCCC1
InChIInChI=1S/C17H30N4/c1-5-18-13-16-14(2)12-15(3)19-17(16)20(4)10-11-21-8-6-7-9-21/h12,18H,5-11,13H2,1-4H3
InChIKeyCXHCRYQEACGCSS-UHFFFAOYSA-N
XLogP2.34
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.46
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine?
The IUPAC name of 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine (CID 63211011) is 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine.
What is the SMILES notation for 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine?
The canonical SMILES for 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine is CCNCc1c(C)cc(C)nc1N(C)CCN1CCCC1.
What is the InChIKey of 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine?
The InChIKey is CXHCRYQEACGCSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-5-18-13-16-14(2)12-15(3)19-17(16)20(4)10-11-21-8-6-7-9-21/h12,18H,5-11,13H2,1-4H3.
What are the key properties of 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine?
3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine has a molecular weight of 290.46 g/mol, XLogP of 2.34, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine is sourced from PubChem (CID 63211011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).