2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine

C9H15N3 — CID 86340808

IUPAC2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine
SMILESNC1=CC=CNC1N1CCCC1
InChIInChI=1S/C9H15N3/c10-8-4-3-5-11-9(8)12-6-1-2-7-12/h3-5,9,11H,1-2,6-7,10H2
InChIKeyOITNFSKOBQVXLJ-UHFFFAOYSA-N
MW165.24 g/mol
LogP0.37
Rot. Bonds1

About 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine

2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine (PubChem CID 86340808) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine.

Molecular Properties

Compound Name2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine
PubChem CID86340808
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine
SMILESNC1=CC=CNC1N1CCCC1
InChIInChI=1S/C9H15N3/c10-8-4-3-5-11-9(8)12-6-1-2-7-12/h3-5,9,11H,1-2,6-7,10H2
InChIKeyOITNFSKOBQVXLJ-UHFFFAOYSA-N
XLogP0.37
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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1-[(3-butyl-1,2-dihydroimidazol-4-yl)methyl]-2H-pyridine
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2,4-Bis-pyrrolidinodihydropyridin
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3,8-Diazabicyclo[2.3.1]octa-1(7),5-diene
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2-Pyrrolidin-1-yl-1,2-dihydropyridine
CID 21071163
2,3,3a,4-tetrahydro-1H-imidazo[4,5-b]pyridine;dihydrochloride
CID 66973714
1-(1-prop-2-enyl-2H-pyridin-3-yl)imidazolidin-2-one
CID 67904599
1,2,3,8a-Tetrahydroimidazo[1,2-a]pyridine
CID 68089779
1,2,3,5-Tetrahydroimidazo[1,5-a]pyridine
CID 68440928
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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine?
The IUPAC name of 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine (CID 86340808) is 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine.
What is the SMILES notation for 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine?
The canonical SMILES for 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine is NC1=CC=CNC1N1CCCC1.
What is the InChIKey of 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine?
The InChIKey is OITNFSKOBQVXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c10-8-4-3-5-11-9(8)12-6-1-2-7-12/h3-5,9,11H,1-2,6-7,10H2.
What are the key properties of 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine?
2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine has a molecular weight of 165.24 g/mol, XLogP of 0.37, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-1-yl-1,2-dihydropyridin-3-amine is sourced from PubChem (CID 86340808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).