[2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine

C15H25N3 — CID 113381419

IUPAC[2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine
SMILESCC(C)c1cc(CN)cc(N2CC(C)C(C)C2)n1
InChIInChI=1S/C15H25N3/c1-10(2)14-5-13(7-16)6-15(17-14)18-8-11(3)12(4)9-18/h5-6,10-12H,7-9,16H2,1-4H3
InChIKeySOASZWBZQDMLHP-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.76
Rot. Bonds3

About [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine

[2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine (PubChem CID 113381419) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine
PubChem CID113381419
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name[2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine
SMILESCC(C)c1cc(CN)cc(N2CC(C)C(C)C2)n1
InChIInChI=1S/C15H25N3/c1-10(2)14-5-13(7-16)6-15(17-14)18-8-11(3)12(4)9-18/h5-6,10-12H,7-9,16H2,1-4H3
InChIKeySOASZWBZQDMLHP-UHFFFAOYSA-N
XLogP2.76
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine?
The IUPAC name of [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine (CID 113381419) is [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine?
The canonical SMILES for [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine is CC(C)c1cc(CN)cc(N2CC(C)C(C)C2)n1.
What is the InChIKey of [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine?
The InChIKey is SOASZWBZQDMLHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-10(2)14-5-13(7-16)6-15(17-14)18-8-11(3)12(4)9-18/h5-6,10-12H,7-9,16H2,1-4H3.
What are the key properties of [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine?
[2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine has a molecular weight of 247.39 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine is sourced from PubChem (CID 113381419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).