N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine

C13H21N3 — CID 115922482

IUPACN-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine
SMILESCc1cc(C)nc(NC2CC(C)N(C)C2)c1
InChIInChI=1S/C13H21N3/c1-9-5-10(2)14-13(6-9)15-12-7-11(3)16(4)8-12/h5-6,11-12H,7-8H2,1-4H3,(H,14,15)
InChIKeyTZGBDIBCMFWGOP-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.20
Rot. Bonds2

About N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine

N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine (PubChem CID 115922482) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine.

Molecular Properties

Compound NameN-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine
PubChem CID115922482
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine
SMILESCc1cc(C)nc(NC2CC(C)N(C)C2)c1
InChIInChI=1S/C13H21N3/c1-9-5-10(2)14-13(6-9)15-12-7-11(3)16(4)8-12/h5-6,11-12H,7-8H2,1-4H3,(H,14,15)
InChIKeyTZGBDIBCMFWGOP-UHFFFAOYSA-N
XLogP2.20
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine?
The IUPAC name of N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine (CID 115922482) is N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine.
What is the SMILES notation for N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine?
The canonical SMILES for N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine is Cc1cc(C)nc(NC2CC(C)N(C)C2)c1.
What is the InChIKey of N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine?
The InChIKey is TZGBDIBCMFWGOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9-5-10(2)14-13(6-9)15-12-7-11(3)16(4)8-12/h5-6,11-12H,7-8H2,1-4H3,(H,14,15).
What are the key properties of N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine?
N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine has a molecular weight of 219.33 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrrolidin-3-yl)-4,6-dimethylpyridin-2-amine is sourced from PubChem (CID 115922482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).