(5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine

C15H23N3 — CID 155623818

IUPAC(5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine
SMILESCC(C)N1CCC2(CC1)Cc1ncccc1[C@H]2N
InChIInChI=1S/C15H23N3/c1-11(2)18-8-5-15(6-9-18)10-13-12(14(15)16)4-3-7-17-13/h3-4,7,11,14H,5-6,8-10,16H2,1-2H3/t14-/m1/s1
InChIKeyXXZDOKITUNNZAK-CQSZACIVSA-N
MW245.37 g/mol
LogP2.13
Rot. Bonds1

About (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine

(5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine (PubChem CID 155623818) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine.

Molecular Properties

Compound Name(5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine
PubChem CID155623818
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name(5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine
SMILESCC(C)N1CCC2(CC1)Cc1ncccc1[C@H]2N
InChIInChI=1S/C15H23N3/c1-11(2)18-8-5-15(6-9-18)10-13-12(14(15)16)4-3-7-17-13/h3-4,7,11,14H,5-6,8-10,16H2,1-2H3/t14-/m1/s1
InChIKeyXXZDOKITUNNZAK-CQSZACIVSA-N
XLogP2.13
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine?
The IUPAC name of (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine (CID 155623818) is (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine.
What is the SMILES notation for (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine?
The canonical SMILES for (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine is CC(C)N1CCC2(CC1)Cc1ncccc1[C@H]2N.
What is the InChIKey of (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine?
The InChIKey is XXZDOKITUNNZAK-CQSZACIVSA-N. The full InChI is InChI=1S/C15H23N3/c1-11(2)18-8-5-15(6-9-18)10-13-12(14(15)16)4-3-7-17-13/h3-4,7,11,14H,5-6,8-10,16H2,1-2H3/t14-/m1/s1.
What are the key properties of (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine?
(5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine has a molecular weight of 245.37 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-1'-propan-2-ylspiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine is sourced from PubChem (CID 155623818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).