3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine

C17H23N3 — CID 65484864

IUPAC3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine
SMILESCc1cc(C)c(CN)c(N(C)CCc2ccccc2)n1
InChIInChI=1S/C17H23N3/c1-13-11-14(2)19-17(16(13)12-18)20(3)10-9-15-7-5-4-6-8-15/h4-8,11H,9-10,12,18H2,1-3H3
InChIKeyGCAQEWPWPXTGOO-UHFFFAOYSA-N
MW269.39 g/mol
LogP2.84
Rot. Bonds5

About 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine

3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine (PubChem CID 65484864) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine
PubChem CID65484864
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine
SMILESCc1cc(C)c(CN)c(N(C)CCc2ccccc2)n1
InChIInChI=1S/C17H23N3/c1-13-11-14(2)19-17(16(13)12-18)20(3)10-9-15-7-5-4-6-8-15/h4-8,11H,9-10,12,18H2,1-3H3
InChIKeyGCAQEWPWPXTGOO-UHFFFAOYSA-N
XLogP2.84
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine (CID 65484864) is 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine is Cc1cc(C)c(CN)c(N(C)CCc2ccccc2)n1.
What is the InChIKey of 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine?
The InChIKey is GCAQEWPWPXTGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-13-11-14(2)19-17(16(13)12-18)20(3)10-9-15-7-5-4-6-8-15/h4-8,11H,9-10,12,18H2,1-3H3.
What are the key properties of 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine?
3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine has a molecular weight of 269.39 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N,4,6-trimethyl-N-(2-phenylethyl)pyridin-2-amine is sourced from PubChem (CID 65484864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).