N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine

C15H23N3O — CID 102774345

IUPACN-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
SMILESCCN1CCOC(CNC2CCc3cccnc32)C1
InChIInChI=1S/C15H23N3O/c1-2-18-8-9-19-13(11-18)10-17-14-6-5-12-4-3-7-16-15(12)14/h3-4,7,13-14,17H,2,5-6,8-11H2,1H3
InChIKeyXUFMDGAUBSLNRJ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.38
Rot. Bonds4

About N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine

N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine (PubChem CID 102774345) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine.

Molecular Properties

Compound NameN-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
PubChem CID102774345
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
SMILESCCN1CCOC(CNC2CCc3cccnc32)C1
InChIInChI=1S/C15H23N3O/c1-2-18-8-9-19-13(11-18)10-17-14-6-5-12-4-3-7-16-15(12)14/h3-4,7,13-14,17H,2,5-6,8-11H2,1H3
InChIKeyXUFMDGAUBSLNRJ-UHFFFAOYSA-N
XLogP1.38
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine?
The IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine (CID 102774345) is N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine.
What is the SMILES notation for N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine?
The canonical SMILES for N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine is CCN1CCOC(CNC2CCc3cccnc32)C1.
What is the InChIKey of N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine?
The InChIKey is XUFMDGAUBSLNRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-18-8-9-19-13(11-18)10-17-14-6-5-12-4-3-7-16-15(12)14/h3-4,7,13-14,17H,2,5-6,8-11H2,1H3.
What are the key properties of N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine?
N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine has a molecular weight of 261.37 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine is sourced from PubChem (CID 102774345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).