1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane

C18H22N4 — CID 134073217

IUPAC1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane
SMILESc1ccc(CN2CCC3(CC2)CCN3c2cccnc2)nc1
InChIInChI=1S/C18H22N4/c1-2-10-20-16(4-1)15-21-11-6-18(7-12-21)8-13-22(18)17-5-3-9-19-14-17/h1-5,9-10,14H,6-8,11-13,15H2
InChIKeyACIVHDRZZUISHF-UHFFFAOYSA-N
MW294.40 g/mol
LogP2.72
Rot. Bonds3

About 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane

1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane (PubChem CID 134073217) has the molecular formula C18H22N4 and a molecular weight of 294.40 g/mol. Its IUPAC name is 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane
PubChem CID134073217
Molecular FormulaC18H22N4
Molecular Weight294.40 g/mol
Exact Mass294.18
IUPAC Name1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane
SMILESc1ccc(CN2CCC3(CC2)CCN3c2cccnc2)nc1
InChIInChI=1S/C18H22N4/c1-2-10-20-16(4-1)15-21-11-6-18(7-12-21)8-13-22(18)17-5-3-9-19-14-17/h1-5,9-10,14H,6-8,11-13,15H2
InChIKeyACIVHDRZZUISHF-UHFFFAOYSA-N
XLogP2.72
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(5R)-6-acetyl-9-pyridin-3-yl-2-(pyridin-2-ylmethyl)-2,6,9-triazaspiro[4.5]decan-8-one
CID 97373462
3-(pyridin-2-ylmethyl)-9-(2-pyrrolidin-1-ylethyl)-3,9-diazaspiro[5.5]undecane
CID 97450332
(6R)-11-pyridin-3-yl-2-(pyridin-2-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 97372839
2-pyridin-3-yl-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decan-1-one
CID 134075103
1-phenyl-4-(pyridin-2-ylmethyl)piperazine
CID 1090338
1-(pyridin-2-ylmethyl)piperidine-4,4-dicarbonitrile
CID 117007901
4-pyridin-3-yl-9-(pyridin-2-ylmethyl)-1-oxa-4,9-diazaspiro[5.5]undecan-3-one;bis(2,2,2-trifluoroacetic acid)
CID 171696964
pyridin-3-yl-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone
CID 704367
8-(pyridin-2-ylmethyl)-3-(pyridin-3-yloxymethyl)-2-oxa-8-azaspiro[4.5]decane
CID 131646237
6,6-difluoro-2-pyridin-3-yl-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane;bis(2,2,2-trifluoroacetic acid)
CID 171685860
1'-(pyridin-2-ylmethyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 97375615
pyridin-3-yl-[8-(pyridin-2-ylmethyl)-2,8-diazaspiro[4.5]decan-2-yl]methanone;bis(2,2,2-trifluoroacetic acid)
CID 155859302

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane?
The IUPAC name of 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane (CID 134073217) is 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane?
The canonical SMILES for 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane is c1ccc(CN2CCC3(CC2)CCN3c2cccnc2)nc1.
What is the InChIKey of 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane?
The InChIKey is ACIVHDRZZUISHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4/c1-2-10-20-16(4-1)15-21-11-6-18(7-12-21)8-13-22(18)17-5-3-9-19-14-17/h1-5,9-10,14H,6-8,11-13,15H2.
What are the key properties of 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane?
1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane has a molecular weight of 294.40 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-3-yl-7-(pyridin-2-ylmethyl)-1,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 134073217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).