[2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine

C16H25N3 — CID 62935971

IUPAC[2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
SMILESCC1(C)CCN(c2nc3c(cc2CN)CCC3)CC1
InChIInChI=1S/C16H25N3/c1-16(2)6-8-19(9-7-16)15-13(11-17)10-12-4-3-5-14(12)18-15/h10H,3-9,11,17H2,1-2H3
InChIKeyKJIKAJHHICQBSG-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.66
Rot. Bonds2

About [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine

[2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine (PubChem CID 62935971) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
PubChem CID62935971
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name[2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
SMILESCC1(C)CCN(c2nc3c(cc2CN)CCC3)CC1
InChIInChI=1S/C16H25N3/c1-16(2)6-8-19(9-7-16)15-13(11-17)10-12-4-3-5-14(12)18-15/h10H,3-9,11,17H2,1-2H3
InChIKeyKJIKAJHHICQBSG-UHFFFAOYSA-N
XLogP2.66
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine?
The IUPAC name of [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine (CID 62935971) is [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine.
What is the SMILES notation for [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine?
The canonical SMILES for [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine is CC1(C)CCN(c2nc3c(cc2CN)CCC3)CC1.
What is the InChIKey of [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine?
The InChIKey is KJIKAJHHICQBSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-16(2)6-8-19(9-7-16)15-13(11-17)10-12-4-3-5-14(12)18-15/h10H,3-9,11,17H2,1-2H3.
What are the key properties of [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine?
[2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine has a molecular weight of 259.40 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4,4-dimethylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine is sourced from PubChem (CID 62935971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).