N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine

C12H19N3 — CID 106321908

IUPACN-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine
SMILESCNCC1(C)CCN(c2ccncc2)C1
InChIInChI=1S/C12H19N3/c1-12(9-13-2)5-8-15(10-12)11-3-6-14-7-4-11/h3-4,6-7,13H,5,8-10H2,1-2H3
InChIKeyHVCLCULMQNSZHT-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.52
Rot. Bonds3

About N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine

N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine (PubChem CID 106321908) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine
PubChem CID106321908
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine
SMILESCNCC1(C)CCN(c2ccncc2)C1
InChIInChI=1S/C12H19N3/c1-12(9-13-2)5-8-15(10-12)11-3-6-14-7-4-11/h3-4,6-7,13H,5,8-10H2,1-2H3
InChIKeyHVCLCULMQNSZHT-UHFFFAOYSA-N
XLogP1.52
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,3-dimethylpyrrolidin-1-yl)pyridine
CID 67580177
1-(1-isoquinolin-1-yl-3-methylpyrrolidin-3-yl)-N-methylmethanamine
CID 106321968
1-[1-(5-bromopyrimidin-2-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106321701
1-[1-(5-methoxy-2-pyridinyl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106321981
1-[1-(3-bromo-5-chloro-2-pyridinyl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106321819
N-methyl-1-[3-methyl-1-(1,3,4-thiadiazol-2-yl)pyrrolidin-3-yl]methanamine
CID 106321971
N-methyl-1-[3-methyl-1-(4-propoxypyrimidin-2-yl)pyrrolidin-3-yl]methanamine
CID 106321862
N-methyl-1-[3-methyl-1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]methanamine
CID 106321729
1-[1-(6-methoxy-2-methylpyrimidin-4-yl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106321931
1-[1-(2-ethylsulfonylphenyl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106321793
3-ethyl-1-pyridin-4-ylpyrrolidine-3-carboxylic acid
CID 63147374
(3R)-3-propan-2-yl-1-pyridin-4-ylpyrrolidin-3-amine
CID 97181815

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine?
The IUPAC name of N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine (CID 106321908) is N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine is CNCC1(C)CCN(c2ccncc2)C1.
What is the InChIKey of N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine?
The InChIKey is HVCLCULMQNSZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-12(9-13-2)5-8-15(10-12)11-3-6-14-7-4-11/h3-4,6-7,13H,5,8-10H2,1-2H3.
What are the key properties of N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine?
N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine has a molecular weight of 205.31 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methyl-1-pyridin-4-ylpyrrolidin-3-yl)methanamine is sourced from PubChem (CID 106321908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).