N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine

C19H26N4 — CID 23373523

IUPACN,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCCN(CCC)C1CCc2cccc(-c3ncncn3)c2C1
InChIInChI=1S/C19H26N4/c1-3-10-23(11-4-2)16-9-8-15-6-5-7-17(18(15)12-16)19-21-13-20-14-22-19/h5-7,13-14,16H,3-4,8-12H2,1-2H3
InChIKeyJRADAKSTIZEHKN-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.52
Rot. Bonds6

About N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine

N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 23373523) has the molecular formula C19H26N4 and a molecular weight of 310.44 g/mol. Its IUPAC name is N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID23373523
Molecular FormulaC19H26N4
Molecular Weight310.44 g/mol
Exact Mass310.22
IUPAC NameN,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCCN(CCC)C1CCc2cccc(-c3ncncn3)c2C1
InChIInChI=1S/C19H26N4/c1-3-10-23(11-4-2)16-9-8-15-6-5-7-17(18(15)12-16)19-21-13-20-14-22-19/h5-7,13-14,16H,3-4,8-12H2,1-2H3
InChIKeyJRADAKSTIZEHKN-UHFFFAOYSA-N
XLogP3.52
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine (CID 23373523) is N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine is CCCN(CCC)C1CCc2cccc(-c3ncncn3)c2C1.
What is the InChIKey of N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is JRADAKSTIZEHKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4/c1-3-10-23(11-4-2)16-9-8-15-6-5-7-17(18(15)12-16)19-21-13-20-14-22-19/h5-7,13-14,16H,3-4,8-12H2,1-2H3.
What are the key properties of N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine?
N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 310.44 g/mol, XLogP of 3.52, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 23373523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).