1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine

C14H23N3 — CID 80635207

IUPAC1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine
SMILESCC(N)Cc1ccc(N2CCC(C)(C)C2)nc1
InChIInChI=1S/C14H23N3/c1-11(15)8-12-4-5-13(16-9-12)17-7-6-14(2,3)10-17/h4-5,9,11H,6-8,10,15H2,1-3H3
InChIKeyHHJMSRKZMSOFMO-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.21
Rot. Bonds3

About 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine

1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine (PubChem CID 80635207) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine.

Molecular Properties

Compound Name1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine
PubChem CID80635207
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine
SMILESCC(N)Cc1ccc(N2CCC(C)(C)C2)nc1
InChIInChI=1S/C14H23N3/c1-11(15)8-12-4-5-13(16-9-12)17-7-6-14(2,3)10-17/h4-5,9,11H,6-8,10,15H2,1-3H3
InChIKeyHHJMSRKZMSOFMO-UHFFFAOYSA-N
XLogP2.21
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(3,3-diethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine
CID 80634327
[6-(4,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine
CID 62937885
1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine
CID 80634559
1-[6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-3-pyridinyl]propan-2-amine
CID 80635204
1-[6-(3-propan-2-ylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine
CID 113419282
ethyl 1-[5-(2-aminopropyl)-2-pyridinyl]piperidine-4-carboxylate
CID 170891147
5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine
CID 59000961
5-(2-aminopropyl)-N-(4,4-dimethylcyclohexyl)-N-methylpyridin-2-amine
CID 80634982
1-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]propan-2-amine
CID 80633955
1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]propan-2-amine
CID 80633070
1-[6-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-3-pyridinyl]propan-2-amine
CID 80634441
N-[[6-(2,2-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62281742

Frequently Asked Questions

What is the IUPAC name of 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine?
The IUPAC name of 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine (CID 80635207) is 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine.
What is the SMILES notation for 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine?
The canonical SMILES for 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine is CC(N)Cc1ccc(N2CCC(C)(C)C2)nc1.
What is the InChIKey of 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine?
The InChIKey is HHJMSRKZMSOFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-11(15)8-12-4-5-13(16-9-12)17-7-6-14(2,3)10-17/h4-5,9,11H,6-8,10,15H2,1-3H3.
What are the key properties of 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine?
1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine has a molecular weight of 233.36 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine is sourced from PubChem (CID 80635207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).