5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine

C14H25N5 — CID 106642559

IUPAC5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine
SMILESCCCN(CC1CCCCN1)c1nnc(C)c(C)n1
InChIInChI=1S/C14H25N5/c1-4-9-19(10-13-7-5-6-8-15-13)14-16-11(2)12(3)17-18-14/h13,15H,4-10H2,1-3H3
InChIKeySYGNCUTZFFHFAW-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.85
Rot. Bonds5

About 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine

5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine (PubChem CID 106642559) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine.

Molecular Properties

Compound Name5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine
PubChem CID106642559
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine
SMILESCCCN(CC1CCCCN1)c1nnc(C)c(C)n1
InChIInChI=1S/C14H25N5/c1-4-9-19(10-13-7-5-6-8-15-13)14-16-11(2)12(3)17-18-14/h13,15H,4-10H2,1-3H3
InChIKeySYGNCUTZFFHFAW-UHFFFAOYSA-N
XLogP1.85
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine?
The IUPAC name of 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine (CID 106642559) is 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine.
What is the SMILES notation for 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine?
The canonical SMILES for 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine is CCCN(CC1CCCCN1)c1nnc(C)c(C)n1.
What is the InChIKey of 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine?
The InChIKey is SYGNCUTZFFHFAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-4-9-19(10-13-7-5-6-8-15-13)14-16-11(2)12(3)17-18-14/h13,15H,4-10H2,1-3H3.
What are the key properties of 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine?
5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine has a molecular weight of 263.39 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine is sourced from PubChem (CID 106642559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).