(6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone

C15H20ClN3O — CID 63162057

IUPAC(6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone
SMILESNc1ccc(Cl)c(C(=O)N2CCC3(CCCC3)CC2)n1
InChIInChI=1S/C15H20ClN3O/c16-11-3-4-12(17)18-13(11)14(20)19-9-7-15(8-10-19)5-1-2-6-15/h3-4H,1-2,5-10H2,(H2,17,18)
InChIKeyWIJJWDNJOUNXCV-UHFFFAOYSA-N
MW293.80 g/mol
LogP3.11
Rot. Bonds1

About (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone

(6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone (PubChem CID 63162057) has the molecular formula C15H20ClN3O and a molecular weight of 293.80 g/mol. Its IUPAC name is (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone.

Molecular Properties

Compound Name(6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone
PubChem CID63162057
Molecular FormulaC15H20ClN3O
Molecular Weight293.80 g/mol
Exact Mass293.13
IUPAC Name(6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone
SMILESNc1ccc(Cl)c(C(=O)N2CCC3(CCCC3)CC2)n1
InChIInChI=1S/C15H20ClN3O/c16-11-3-4-12(17)18-13(11)14(20)19-9-7-15(8-10-19)5-1-2-6-15/h3-4H,1-2,5-10H2,(H2,17,18)
InChIKeyWIJJWDNJOUNXCV-UHFFFAOYSA-N
XLogP3.11
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone?
The IUPAC name of (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone (CID 63162057) is (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone.
What is the SMILES notation for (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone?
The canonical SMILES for (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone is Nc1ccc(Cl)c(C(=O)N2CCC3(CCCC3)CC2)n1.
What is the InChIKey of (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone?
The InChIKey is WIJJWDNJOUNXCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O/c16-11-3-4-12(17)18-13(11)14(20)19-9-7-15(8-10-19)5-1-2-6-15/h3-4H,1-2,5-10H2,(H2,17,18).
What are the key properties of (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone?
(6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone has a molecular weight of 293.80 g/mol, XLogP of 3.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-amino-3-chloro-2-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone is sourced from PubChem (CID 63162057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).