4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen

C15H28N4 — CID 142583556

IUPAC4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen
SMILESC=C(N)C1=CC(N(C)C2CCN(C)CC2)=NCC1C.[H][H]
InChIInChI=1S/C15H26N4.H2/c1-11-10-17-15(9-14(11)12(2)16)19(4)13-5-7-18(3)8-6-13;/h9,11,13H,2,5-8,10,16H2,1,3-4H3;1H
InChIKeyGATDGZVNPDOFAS-UHFFFAOYSA-N
MW264.42 g/mol
LogP1.71
Rot. Bonds2

About 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen

4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen (PubChem CID 142583556) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen.

Molecular Properties

Compound Name4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen
PubChem CID142583556
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen
SMILESC=C(N)C1=CC(N(C)C2CCN(C)CC2)=NCC1C.[H][H]
InChIInChI=1S/C15H26N4.H2/c1-11-10-17-15(9-14(11)12(2)16)19(4)13-5-7-18(3)8-6-13;/h9,11,13H,2,5-8,10,16H2,1,3-4H3;1H
InChIKeyGATDGZVNPDOFAS-UHFFFAOYSA-N
XLogP1.71
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen?
The IUPAC name of 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen (CID 142583556) is 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen.
What is the SMILES notation for 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen?
The canonical SMILES for 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen is C=C(N)C1=CC(N(C)C2CCN(C)CC2)=NCC1C.[H][H].
What is the InChIKey of 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen?
The InChIKey is GATDGZVNPDOFAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4.H2/c1-11-10-17-15(9-14(11)12(2)16)19(4)13-5-7-18(3)8-6-13;/h9,11,13H,2,5-8,10,16H2,1,3-4H3;1H.
What are the key properties of 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen?
4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen has a molecular weight of 264.42 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen is sourced from PubChem (CID 142583556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).