N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine

C18H23N3 — CID 130546436

IUPACN-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine
SMILESCc1ncccc1NC1CCN(Cc2ccccc2)C1C
InChIInChI=1S/C18H23N3/c1-14-17(9-6-11-19-14)20-18-10-12-21(15(18)2)13-16-7-4-3-5-8-16/h3-9,11,15,18,20H,10,12-13H2,1-2H3
InChIKeyUZIUDXRSMAZSSS-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.46
Rot. Bonds4

About N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine

N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine (PubChem CID 130546436) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine.

Molecular Properties

Compound NameN-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine
PubChem CID130546436
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC NameN-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine
SMILESCc1ncccc1NC1CCN(Cc2ccccc2)C1C
InChIInChI=1S/C18H23N3/c1-14-17(9-6-11-19-14)20-18-10-12-21(15(18)2)13-16-7-4-3-5-8-16/h3-9,11,15,18,20H,10,12-13H2,1-2H3
InChIKeyUZIUDXRSMAZSSS-UHFFFAOYSA-N
XLogP3.46
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-benzyl-2-methylpyrrolidin-3-yl)-5-methylpyridin-2-amine
CID 130558893
N-(1-benzyl-2-methylpyrrolidin-3-yl)-6-bromo-2-methylpyrimidin-4-amine
CID 130559000
N-(1-benzylpiperidin-3-yl)-2-methylpyridin-3-amine
CID 79042917
N-(1-benzyl-2-methylpyrrolidin-3-yl)-3,6-dichloro-1,2,4-triazin-5-amine
CID 130559015
1-amino-3-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylguanidine
CID 130559150
1-benzyl-3-chloro-2-methylpyrrolidine
CID 67849385
2-(1-benzylpiperidin-2-yl)-3-methylpyridine
CID 102539039
N-(2,4-dimethylcyclohexyl)-2-methylpyridin-3-amine
CID 79042594
N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-(4-methylcyclohexyl)oxyacetamide
CID 167992740
(2R,3R)-1-benzyl-3-fluoro-2-methylpyrrolidine
CID 126557725
(2S,3R)-1-benzyl-3-fluoro-2-methylpyrrolidine
CID 126524305
4-[(1-benzyl-2-methylpyrrolidin-3-yl)sulfamoyl]-5-methylthiophene-2-carboxylic acid
CID 167796937

Frequently Asked Questions

What is the IUPAC name of N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine?
The IUPAC name of N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine (CID 130546436) is N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine.
What is the SMILES notation for N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine?
The canonical SMILES for N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine is Cc1ncccc1NC1CCN(Cc2ccccc2)C1C.
What is the InChIKey of N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine?
The InChIKey is UZIUDXRSMAZSSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-14-17(9-6-11-19-14)20-18-10-12-21(15(18)2)13-16-7-4-3-5-8-16/h3-9,11,15,18,20H,10,12-13H2,1-2H3.
What are the key properties of N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine?
N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine has a molecular weight of 281.40 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzyl-2-methylpyrrolidin-3-yl)-2-methylpyridin-3-amine is sourced from PubChem (CID 130546436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).