6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine

C14H23N3 — CID 118747423

IUPAC6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine
SMILESCC(C)Nc1cccc(CC2CCN(C)C2)n1
InChIInChI=1S/C14H23N3/c1-11(2)15-14-6-4-5-13(16-14)9-12-7-8-17(3)10-12/h4-6,11-12H,7-10H2,1-3H3,(H,15,16)
InChIKeyOGXXAZOJPVXSPB-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.40
Rot. Bonds4

About 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine

6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine (PubChem CID 118747423) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine
PubChem CID118747423
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine
SMILESCC(C)Nc1cccc(CC2CCN(C)C2)n1
InChIInChI=1S/C14H23N3/c1-11(2)15-14-6-4-5-13(16-14)9-12-7-8-17(3)10-12/h4-6,11-12H,7-10H2,1-3H3,(H,15,16)
InChIKeyOGXXAZOJPVXSPB-UHFFFAOYSA-N
XLogP2.40
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine?
The IUPAC name of 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine (CID 118747423) is 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine?
The canonical SMILES for 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine is CC(C)Nc1cccc(CC2CCN(C)C2)n1.
What is the InChIKey of 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine?
The InChIKey is OGXXAZOJPVXSPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-11(2)15-14-6-4-5-13(16-14)9-12-7-8-17(3)10-12/h4-6,11-12H,7-10H2,1-3H3,(H,15,16).
What are the key properties of 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine?
6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine has a molecular weight of 233.36 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-methylpyrrolidin-3-yl)methyl]-N-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 118747423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).