4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine

C10H15N3 — CID 138645949

IUPAC4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine
SMILESNC1CN=CC=C1C1=NCCCC1
InChIInChI=1S/C10H15N3/c11-9-7-12-6-4-8(9)10-3-1-2-5-13-10/h4,6,9H,1-3,5,7,11H2
InChIKeyZAOHFUFFSVBMKL-UHFFFAOYSA-N
MW177.25 g/mol
LogP0.95
Rot. Bonds1

About 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine

4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine (PubChem CID 138645949) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine.

Molecular Properties

Compound Name4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine
PubChem CID138645949
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine
SMILESNC1CN=CC=C1C1=NCCCC1
InChIInChI=1S/C10H15N3/c11-9-7-12-6-4-8(9)10-3-1-2-5-13-10/h4,6,9H,1-3,5,7,11H2
InChIKeyZAOHFUFFSVBMKL-UHFFFAOYSA-N
XLogP0.95
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine?
The IUPAC name of 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine (CID 138645949) is 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine.
What is the SMILES notation for 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine?
The canonical SMILES for 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine is NC1CN=CC=C1C1=NCCCC1.
What is the InChIKey of 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine?
The InChIKey is ZAOHFUFFSVBMKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c11-9-7-12-6-4-8(9)10-3-1-2-5-13-10/h4,6,9H,1-3,5,7,11H2.
What are the key properties of 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine?
4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine has a molecular weight of 177.25 g/mol, XLogP of 0.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3,4,5-tetrahydropyridin-6-yl)-2,3-dihydropyridin-3-amine is sourced from PubChem (CID 138645949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).