N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine

C12H19N3 — CID 81468176

IUPACN-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine
SMILESCc1ncccc1NC1CC(C)N(C)C1
InChIInChI=1S/C12H19N3/c1-9-7-11(8-15(9)3)14-12-5-4-6-13-10(12)2/h4-6,9,11,14H,7-8H2,1-3H3
InChIKeyBXNZSOVFTIURBO-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.89
Rot. Bonds2

About N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine

N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine (PubChem CID 81468176) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine.

Molecular Properties

Compound NameN-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine
PubChem CID81468176
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine
SMILESCc1ncccc1NC1CC(C)N(C)C1
InChIInChI=1S/C12H19N3/c1-9-7-11(8-15(9)3)14-12-5-4-6-13-10(12)2/h4-6,9,11,14H,7-8H2,1-3H3
InChIKeyBXNZSOVFTIURBO-UHFFFAOYSA-N
XLogP1.89
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.89
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)-2-methylpyridin-3-amine?
The IUPAC name of N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine (CID 81468176) is N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine.
What is the SMILES notation for N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine?
The canonical SMILES for N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine is Cc1ncccc1NC1CC(C)N(C)C1.
What is the InChIKey of N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine?
The InChIKey is BXNZSOVFTIURBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-9-7-11(8-15(9)3)14-12-5-4-6-13-10(12)2/h4-6,9,11,14H,7-8H2,1-3H3.
What are the key properties of N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine?
N-(1,5-dimethylpyrrolidin-3-yl)-2-methylpyridin-3-amine has a molecular weight of 205.31 g/mol, XLogP of 1.89, 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)-2-methylpyridin-3-amine is sourced from PubChem (CID 81468176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).