[2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine

C15H23N3 — CID 63215740

IUPAC[2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
SMILESCC1(C)CCCN1c1nc2c(cc1CN)CCC2
InChIInChI=1S/C15H23N3/c1-15(2)7-4-8-18(15)14-12(10-16)9-11-5-3-6-13(11)17-14/h9H,3-8,10,16H2,1-2H3
InChIKeyYURHMFIYLNZGOQ-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.41
Rot. Bonds2

About [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine

[2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine (PubChem CID 63215740) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
PubChem CID63215740
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name[2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
SMILESCC1(C)CCCN1c1nc2c(cc1CN)CCC2
InChIInChI=1S/C15H23N3/c1-15(2)7-4-8-18(15)14-12(10-16)9-11-5-3-6-13(11)17-14/h9H,3-8,10,16H2,1-2H3
InChIKeyYURHMFIYLNZGOQ-UHFFFAOYSA-N
XLogP2.41
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine?
The IUPAC name of [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine (CID 63215740) is [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine.
What is the SMILES notation for [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine?
The canonical SMILES for [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine is CC1(C)CCCN1c1nc2c(cc1CN)CCC2.
What is the InChIKey of [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine?
The InChIKey is YURHMFIYLNZGOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-15(2)7-4-8-18(15)14-12(10-16)9-11-5-3-6-13(11)17-14/h9H,3-8,10,16H2,1-2H3.
What are the key properties of [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine?
[2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine has a molecular weight of 245.37 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,2-dimethylpyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine is sourced from PubChem (CID 63215740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).