3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine

C15H23N3O — CID 82732653

IUPAC3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
SMILESCC1OCCC1N(C)c1nc2c(cc1CN)CCC2
InChIInChI=1S/C15H23N3O/c1-10-14(6-7-19-10)18(2)15-12(9-16)8-11-4-3-5-13(11)17-15/h8,10,14H,3-7,9,16H2,1-2H3
InChIKeyYDYFYFYKCLYPGG-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.64
Rot. Bonds3

About 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine

3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine (PubChem CID 82732653) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
PubChem CID82732653
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
SMILESCC1OCCC1N(C)c1nc2c(cc1CN)CCC2
InChIInChI=1S/C15H23N3O/c1-10-14(6-7-19-10)18(2)15-12(9-16)8-11-4-3-5-13(11)17-15/h8,10,14H,3-7,9,16H2,1-2H3
InChIKeyYDYFYFYKCLYPGG-UHFFFAOYSA-N
XLogP1.64
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine (CID 82732653) is 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine is CC1OCCC1N(C)c1nc2c(cc1CN)CCC2.
What is the InChIKey of 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine?
The InChIKey is YDYFYFYKCLYPGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-10-14(6-7-19-10)18(2)15-12(9-16)8-11-4-3-5-13(11)17-15/h8,10,14H,3-7,9,16H2,1-2H3.
What are the key properties of 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine?
3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine has a molecular weight of 261.37 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-methyl-N-(2-methyloxolan-3-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine is sourced from PubChem (CID 82732653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).