4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine

C16H26N6 — CID 3107860

IUPAC4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine
SMILESC=CCNc1nc(N2CCCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C16H26N6/c1-2-9-17-14-18-15(21-10-5-3-6-11-21)20-16(19-14)22-12-7-4-8-13-22/h2H,1,3-13H2,(H,17,18,19,20)
InChIKeyUMJVZCVBNCCICF-UHFFFAOYSA-N
MW302.43 g/mol
LogP2.45
Rot. Bonds5

About 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine

4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine (PubChem CID 3107860) has the molecular formula C16H26N6 and a molecular weight of 302.43 g/mol. Its IUPAC name is 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine
PubChem CID3107860
Molecular FormulaC16H26N6
Molecular Weight302.43 g/mol
Exact Mass302.22
IUPAC Name4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine
SMILESC=CCNc1nc(N2CCCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C16H26N6/c1-2-9-17-14-18-15(21-10-5-3-6-11-21)20-16(19-14)22-12-7-4-8-13-22/h2H,1,3-13H2,(H,17,18,19,20)
InChIKeyUMJVZCVBNCCICF-UHFFFAOYSA-N
XLogP2.45
TPSA57.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.43
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

6-piperidin-1-yl-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
CID 101639756
Amino(4,6-dipiperidyl(1,3,5-triazin-2-yl))prop-2-enylcarbonitrile
CID 719064
N-Allyl-4-chloro-6-(1-piperidinyl)-1,3,5-triazin-2-amine
CID 2837384
6-chloro-4-N-pentyl-2-N,2-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
CID 14317546
2,4-Diallylamino-6-(piperazin-1-yl)-1,3,5-triazine
CID 13251299
6-(4-aminopiperidin-1-yl)-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
CID 13271703
3-[[4,6-Di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]propanenitrile
CID 17782991
1-[4-(3,5-Diaminopiperidin-1-yl)-6-(prop-2-enylamino)-1,3,5-triazin-2-yl]piperidine-3,5-diamine
CID 21104235
6-[4-(ethylamino)piperidin-1-yl]-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
CID 56618423
(3R,5R)-1-[4-[(3S,5R)-3,5-diaminopiperidin-1-yl]-6-[methyl(prop-2-enyl)amino]-1,3,5-triazin-2-yl]piperidine-3,5-diamine
CID 58865053
(3R,5S)-1-[4-[(3R,5S)-3,5-diaminopiperidin-1-yl]-6-[methyl(prop-2-enyl)amino]-1,3,5-triazin-2-yl]piperidine-3,5-diamine
CID 58948986
(3S,5R)-1-[4-[(3S,5R)-3,5-diaminopiperidin-1-yl]-6-(prop-2-enylamino)-1,3,5-triazin-2-yl]piperidine-3,5-diamine
CID 58949364

Frequently Asked Questions

What is the IUPAC name of 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine (CID 3107860) is 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine is C=CCNc1nc(N2CCCCC2)nc(N2CCCCC2)n1.
What is the InChIKey of 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine?
The InChIKey is UMJVZCVBNCCICF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N6/c1-2-9-17-14-18-15(21-10-5-3-6-11-21)20-16(19-14)22-12-7-4-8-13-22/h2H,1,3-13H2,(H,17,18,19,20).
What are the key properties of 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine?
4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine has a molecular weight of 302.43 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-di(piperidin-1-yl)-N-prop-2-enyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 3107860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).