1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane

Name: 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₄H₂₁N₃ — CID 118738791

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane

SMILESCc1cccc(CN2CCC23CCCNC3)n1

InChIInChI=1S/C14H21N3/c1-12-4-2-5-13(16-12)10-17-9-7-14(17)6-3-8-15-11-14/h2,4-5,15H,3,6-11H2,1H3

InChIKeySDEWBHMQHJQBFU-UHFFFAOYSA-N

MW231.34 g/mol

LogP1.72

Rot. Bonds2

About 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane

1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane (PubChem CID 118738791) has the molecular formula C₁₄H₂₁N₃ and a molecular weight of 231.34 g/mol. Its IUPAC name is 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name	1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane
PubChem CID	118738791
Molecular Formula	C₁₄H₂₁N₃
Molecular Weight	231.34 g/mol
Exact Mass	231.17
IUPAC Name	1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane
SMILES	Cc1cccc(CN2CCC23CCCNC3)n1
InChI	InChI=1S/C14H21N3/c1-12-4-2-5-13(16-12)10-17-9-7-14(17)6-3-8-15-11-14/h2,4-5,15H,3,6-11H2,1H3
InChIKey	SDEWBHMQHJQBFU-UHFFFAOYSA-N
XLogP	1.72
TPSA	28.16 Å²
H-Bond Donors	1
H-Bond Acceptors	3
Rotatable Bonds	2
Heavy Atoms	17
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	231.34
LogP ≤ 5	1.72
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane?

The IUPAC name of 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane (CID 118738791) is 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane.

What is the SMILES notation for 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane?

The canonical SMILES for 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane is Cc1cccc(CN2CCC23CCCNC3)n1.

What is the InChIKey of 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane?

The InChIKey is SDEWBHMQHJQBFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-12-4-2-5-13(16-12)10-17-9-7-14(17)6-3-8-15-11-14/h2,4-5,15H,3,6-11H2,1H3.

What are the key properties of 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane?

1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane has a molecular weight of 231.34 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(6-methyl-2-pyridinyl)methyl]-1,8-diazaspiro[3.5]nonane is sourced from PubChem (CID 118738791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 118738791 — identifiers, structure, computed properties (public domain)

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