6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine

C11H15N3 — CID 135233044

IUPAC6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine
SMILESCC1C=CC(C2=CCCC(N)=N2)=NC1
InChIInChI=1S/C11H15N3/c1-8-5-6-9(13-7-8)10-3-2-4-11(12)14-10/h3,5-6,8H,2,4,7H2,1H3,(H2,12,14)
InChIKeyBSOKVAPNZWNHBG-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.67
Rot. Bonds1

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

6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine (PubChem CID 135233044) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine.

Molecular Properties

Compound Name6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine
PubChem CID135233044
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine
SMILESCC1C=CC(C2=CCCC(N)=N2)=NC1
InChIInChI=1S/C11H15N3/c1-8-5-6-9(13-7-8)10-3-2-4-11(12)14-10/h3,5-6,8H,2,4,7H2,1H3,(H2,12,14)
InChIKeyBSOKVAPNZWNHBG-UHFFFAOYSA-N
XLogP1.67
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine?
The IUPAC name of 6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine (CID 135233044) is 6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine.
What is the SMILES notation for 6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine?
The canonical SMILES for 6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine is CC1C=CC(C2=CCCC(N)=N2)=NC1.
What is the InChIKey of 6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine?
The InChIKey is BSOKVAPNZWNHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-8-5-6-9(13-7-8)10-3-2-4-11(12)14-10/h3,5-6,8H,2,4,7H2,1H3,(H2,12,14).
What are the key properties of 6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine?
6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine has a molecular weight of 189.26 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methyl-2,3-dihydropyridin-6-yl)-3,4-dihydropyridin-2-amine is sourced from PubChem (CID 135233044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).